USER MOD reduce.3.24.130724 H: found=0, std=0, add=1350, rem=0, adj=46 USER MOD reduce.3.24.130724 removed 1347 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 51 TYR OH : rot 165:sc= -0.471 USER MOD Set 1.2: A 176 THR OG1 : rot 180:sc= 0.00403 USER MOD Set 2.1: A 60 HIS : no HD1:sc= -0.2 X(o=-1.2,f=-1.5) USER MOD Set 2.2: A 80 HIS : no HD1:sc= -1.2! K(o=-1.2!,f=-7.3) USER MOD Set 2.3: A 83 THR OG1 : rot -104:sc= 0.95 USER MOD Set 2.4: A 96 HIS : no HE2:sc= -0.827! C(o=-1.2!,f=-9.7!) USER MOD Set 2.5: A 168 SER OG : rot -116:sc= 0.0384 USER MOD Set 3.1: A 75 THR OG1 : rot 180:sc= 0.901 USER MOD Set 3.2: A 161 SER OG : rot 142:sc= 1.04 USER MOD Set 4.1: A 127 TYR OH : rot -93:sc= 0.658 USER MOD Set 4.2: A 154 CYS SG : rot -117:sc= -0.198 USER MOD Set 5.1: A 122 TYR OH : rot 43:sc= 0.815 USER MOD Set 5.2: A 156 TYR OH : rot 82:sc= 0.246 USER MOD Set 5.3: A 181 THR OG1 : rot 157:sc= 0.75 USER MOD Set 6.1: A 58 THR OG1 : rot 180:sc= 0 USER MOD Set 6.2: A 85 SER OG : rot 37:sc= 0.0813 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -178:sc= -0.19 (180deg=-0.195) USER MOD Single : A 5 THR OG1 : rot 68:sc= 0.834 USER MOD Single : A 10 THR OG1 : rot 60:sc= 1.2 USER MOD Single : A 11 GLN : amide:sc= 0.134 X(o=0.13,f=0) USER MOD Single : A 13 GLN : amide:sc= -0.169 X(o=-0.17,f=0) USER MOD Single : A 15 ASN : amide:sc= -0.0145 K(o=-0.015,f=-1.6) USER MOD Single : A 19 LYS NZ :NH3+ 170:sc= 0.598 (180deg=0.501) USER MOD Single : A 24 SER OG : rot 92:sc= 0.455 USER MOD Single : A 26 HIS : no HD1:sc= -2.27! C(o=-2.3!,f=-5.7!) USER MOD Single : A 28 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 29 SER OG : rot 180:sc= 0 USER MOD Single : A 43 SER OG : rot 102:sc= 0.594 USER MOD Single : A 44 TYR OH : rot 33:sc= -0.667 USER MOD Single : A 56 THR OG1 : rot 180:sc= 0 USER MOD Single : A 62 THR OG1 : rot 41:sc= 0.369 USER MOD Single : A 65 SER OG : rot 180:sc= 0 USER MOD Single : A 70 THR OG1 : rot 180:sc= 0.0938 USER MOD Single : A 71 SER OG : rot -170:sc= 0.00645 USER MOD Single : A 78 TYR OH : rot 47:sc= 0.162 USER MOD Single : A 92 SER OG : rot 180:sc= 0 USER MOD Single : A 100 GLN :FLIP amide:sc= -0.0103 F(o=-0.88,f=-0.01) USER MOD Single : A 105 SER OG : rot -35:sc= 0.525 USER MOD Single : A 107 THR OG1 : rot 180:sc= 0 USER MOD Single : A 115 LYS NZ :NH3+ 151:sc= -0.884 (180deg=-2.12!) USER MOD Single : A 116 THR OG1 : rot 180:sc= 0.265 USER MOD Single : A 117 THR OG1 : rot 180:sc= -0.117 USER MOD Single : A 119 GLN : amide:sc= 0.457 X(o=0.46,f=0) USER MOD Single : A 120 GLN : amide:sc= 0 K(o=0,f=-0.5) USER MOD Single : A 121 SER OG : rot -5:sc= -0.242 USER MOD Single : A 128 MET CE :methyl -154:sc= -0.579 (180deg=-1.7) USER MOD Single : A 137 SER OG : rot 180:sc= 0 USER MOD Single : A 143 THR OG1 : rot 180:sc= 0 USER MOD Single : A 147 ASN : amide:sc= -0.529 K(o=-0.53,f=-1.2) USER MOD Single : A 150 TYR OH : rot 120:sc= -0.0556 USER MOD Single : A 151 SER OG : rot 119:sc= 0.0393 USER MOD Single : A 157 SER OG : rot 108:sc= 0.715 USER MOD Single : A 159 THR OG1 : rot 180:sc= 0 USER MOD Single : A 162 CYS SG : rot 35:sc= 0.0902 USER MOD Single : A 169 ASN : amide:sc= -0.621 K(o=-0.62,f=-2.8) USER MOD Single : A 173 THR OG1 : rot -140:sc= 0 USER MOD Single : A 185 HIS : no HE2:sc= 0.241 K(o=0.24,f=-0.86) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -19.639 4.849 -18.909 1.00 23.21 N ATOM 2 CA MET A 1 -18.244 5.295 -18.673 1.00 42.12 C ATOM 3 C MET A 1 -17.330 4.078 -18.461 1.00 74.43 C ATOM 4 O MET A 1 -16.479 4.058 -17.558 1.00 75.32 O ATOM 5 CB MET A 1 -18.193 6.292 -17.477 1.00 53.34 C ATOM 6 CG MET A 1 -18.918 7.622 -17.737 1.00 62.15 C ATOM 7 SD MET A 1 -18.840 8.763 -16.341 1.00 12.01 S ATOM 8 CE MET A 1 -19.733 10.181 -16.988 1.00 53.44 C ATOM 0 H1 MET A 1 -20.243 5.677 -19.085 1.00 23.21 H new ATOM 0 H2 MET A 1 -19.667 4.218 -19.735 1.00 23.21 H new ATOM 0 H3 MET A 1 -19.987 4.338 -18.072 1.00 23.21 H new ATOM 0 HA MET A 1 -17.876 5.827 -19.550 1.00 42.12 H new ATOM 0 HB2 MET A 1 -18.634 5.815 -16.602 1.00 53.34 H new ATOM 0 HB3 MET A 1 -17.151 6.500 -17.236 1.00 53.34 H new ATOM 0 HG2 MET A 1 -18.481 8.101 -18.613 1.00 62.15 H new ATOM 0 HG3 MET A 1 -19.963 7.418 -17.973 1.00 62.15 H new ATOM 0 HE1 MET A 1 -19.765 10.966 -16.233 1.00 53.44 H new ATOM 0 HE2 MET A 1 -19.227 10.554 -17.879 1.00 53.44 H new ATOM 0 HE3 MET A 1 -20.750 9.884 -17.246 1.00 53.44 H new ATOM 20 N ASP A 2 -17.512 3.075 -19.343 1.00 62.32 N ATOM 21 CA ASP A 2 -16.736 1.820 -19.349 1.00 2.21 C ATOM 22 C ASP A 2 -15.247 2.110 -19.535 1.00 53.40 C ATOM 23 O ASP A 2 -14.421 1.544 -18.832 1.00 12.42 O ATOM 24 CB ASP A 2 -17.231 0.883 -20.485 1.00 72.50 C ATOM 25 CG ASP A 2 -18.721 0.536 -20.373 1.00 64.35 C ATOM 26 OD1 ASP A 2 -19.085 -0.296 -19.522 1.00 73.01 O ATOM 27 OD2 ASP A 2 -19.537 1.110 -21.130 1.00 72.32 O ATOM 0 H ASP A 2 -18.213 3.115 -20.082 1.00 62.32 H new ATOM 0 HA ASP A 2 -16.883 1.326 -18.389 1.00 2.21 H new ATOM 0 HB2 ASP A 2 -17.047 1.360 -21.448 1.00 72.50 H new ATOM 0 HB3 ASP A 2 -16.648 -0.038 -20.469 1.00 72.50 H new ATOM 32 N GLU A 3 -14.951 3.004 -20.497 1.00 51.41 N ATOM 33 CA GLU A 3 -13.580 3.484 -20.794 1.00 55.21 C ATOM 34 C GLU A 3 -12.836 3.887 -19.503 1.00 0.23 C ATOM 35 O GLU A 3 -11.695 3.483 -19.289 1.00 63.24 O ATOM 36 CB GLU A 3 -13.593 4.702 -21.764 1.00 51.53 C ATOM 37 CG GLU A 3 -14.320 4.503 -23.119 1.00 23.53 C ATOM 38 CD GLU A 3 -15.859 4.468 -23.022 1.00 13.22 C ATOM 39 OE1 GLU A 3 -16.460 5.473 -22.593 1.00 34.24 O ATOM 40 OE2 GLU A 3 -16.478 3.430 -23.348 1.00 61.24 O ATOM 0 H GLU A 3 -15.662 3.420 -21.099 1.00 51.41 H new ATOM 0 HA GLU A 3 -13.060 2.654 -21.271 1.00 55.21 H new ATOM 0 HB2 GLU A 3 -14.057 5.543 -21.249 1.00 51.53 H new ATOM 0 HB3 GLU A 3 -12.561 4.985 -21.970 1.00 51.53 H new ATOM 0 HG2 GLU A 3 -14.030 5.308 -23.794 1.00 23.53 H new ATOM 0 HG3 GLU A 3 -13.976 3.571 -23.568 1.00 23.53 H new ATOM 47 N ASP A 4 -13.545 4.643 -18.641 1.00 34.11 N ATOM 48 CA ASP A 4 -13.012 5.160 -17.361 1.00 45.24 C ATOM 49 C ASP A 4 -12.892 4.043 -16.307 1.00 62.33 C ATOM 50 O ASP A 4 -11.965 4.054 -15.491 1.00 50.22 O ATOM 51 CB ASP A 4 -13.925 6.301 -16.836 1.00 1.24 C ATOM 52 CG ASP A 4 -13.485 6.876 -15.470 1.00 12.32 C ATOM 53 OD1 ASP A 4 -12.599 7.758 -15.432 1.00 4.51 O ATOM 54 OD2 ASP A 4 -14.030 6.454 -14.427 1.00 22.44 O ATOM 0 H ASP A 4 -14.513 4.915 -18.814 1.00 34.11 H new ATOM 0 HA ASP A 4 -12.011 5.551 -17.542 1.00 45.24 H new ATOM 0 HB2 ASP A 4 -13.942 7.107 -17.570 1.00 1.24 H new ATOM 0 HB3 ASP A 4 -14.945 5.927 -16.750 1.00 1.24 H new ATOM 59 N THR A 5 -13.821 3.080 -16.332 1.00 10.23 N ATOM 60 CA THR A 5 -13.885 2.013 -15.322 1.00 32.11 C ATOM 61 C THR A 5 -12.762 0.967 -15.550 1.00 2.24 C ATOM 62 O THR A 5 -12.116 0.517 -14.594 1.00 41.11 O ATOM 63 CB THR A 5 -15.297 1.338 -15.329 1.00 41.12 C ATOM 64 OG1 THR A 5 -16.316 2.353 -15.259 1.00 33.33 O ATOM 65 CG2 THR A 5 -15.490 0.357 -14.153 1.00 1.01 C ATOM 0 H THR A 5 -14.546 3.017 -17.047 1.00 10.23 H new ATOM 0 HA THR A 5 -13.727 2.458 -14.340 1.00 32.11 H new ATOM 0 HB THR A 5 -15.376 0.769 -16.255 1.00 41.12 H new ATOM 0 HG1 THR A 5 -16.323 2.868 -16.093 1.00 33.33 H new ATOM 0 HG21 THR A 5 -16.486 -0.083 -14.206 1.00 1.01 H new ATOM 0 HG22 THR A 5 -14.741 -0.433 -14.211 1.00 1.01 H new ATOM 0 HG23 THR A 5 -15.380 0.893 -13.210 1.00 1.01 H new ATOM 73 N GLU A 6 -12.525 0.617 -16.831 1.00 73.22 N ATOM 74 CA GLU A 6 -11.448 -0.314 -17.232 1.00 53.11 C ATOM 75 C GLU A 6 -10.101 0.429 -17.372 1.00 62.24 C ATOM 76 O GLU A 6 -9.057 -0.203 -17.506 1.00 10.32 O ATOM 77 CB GLU A 6 -11.806 -1.029 -18.562 1.00 24.34 C ATOM 78 CG GLU A 6 -11.876 -0.103 -19.794 1.00 4.43 C ATOM 79 CD GLU A 6 -12.175 -0.843 -21.105 1.00 63.21 C ATOM 80 OE1 GLU A 6 -13.349 -1.148 -21.373 1.00 65.33 O ATOM 81 OE2 GLU A 6 -11.233 -1.125 -21.869 1.00 21.31 O ATOM 0 H GLU A 6 -13.073 0.970 -17.615 1.00 73.22 H new ATOM 0 HA GLU A 6 -11.348 -1.066 -16.449 1.00 53.11 H new ATOM 0 HB2 GLU A 6 -11.066 -1.807 -18.751 1.00 24.34 H new ATOM 0 HB3 GLU A 6 -12.769 -1.527 -18.443 1.00 24.34 H new ATOM 0 HG2 GLU A 6 -12.646 0.650 -19.628 1.00 4.43 H new ATOM 0 HG3 GLU A 6 -10.929 0.427 -19.894 1.00 4.43 H new ATOM 88 N ASP A 7 -10.152 1.778 -17.358 1.00 34.31 N ATOM 89 CA ASP A 7 -8.947 2.647 -17.338 1.00 2.34 C ATOM 90 C ASP A 7 -8.061 2.305 -16.131 1.00 30.14 C ATOM 91 O ASP A 7 -6.836 2.379 -16.213 1.00 24.14 O ATOM 92 CB ASP A 7 -9.365 4.134 -17.319 1.00 22.44 C ATOM 93 CG ASP A 7 -8.203 5.120 -17.171 1.00 51.43 C ATOM 94 OD1 ASP A 7 -7.584 5.490 -18.184 1.00 4.30 O ATOM 95 OD2 ASP A 7 -7.909 5.535 -16.038 1.00 0.14 O ATOM 0 H ASP A 7 -11.029 2.300 -17.360 1.00 34.31 H new ATOM 0 HA ASP A 7 -8.365 2.468 -18.242 1.00 2.34 H new ATOM 0 HB2 ASP A 7 -9.900 4.359 -18.241 1.00 22.44 H new ATOM 0 HB3 ASP A 7 -10.064 4.291 -16.498 1.00 22.44 H new ATOM 100 N TRP A 8 -8.731 1.961 -15.013 1.00 71.23 N ATOM 101 CA TRP A 8 -8.104 1.355 -13.827 1.00 72.11 C ATOM 102 C TRP A 8 -7.107 0.240 -14.212 1.00 61.31 C ATOM 103 O TRP A 8 -5.920 0.342 -13.901 1.00 70.41 O ATOM 104 CB TRP A 8 -9.212 0.798 -12.898 1.00 30.02 C ATOM 105 CG TRP A 8 -8.713 0.067 -11.671 1.00 71.23 C ATOM 106 CD1 TRP A 8 -8.151 0.614 -10.545 1.00 73.52 C ATOM 107 CD2 TRP A 8 -8.744 -1.353 -11.451 1.00 20.20 C ATOM 108 NE1 TRP A 8 -7.833 -0.375 -9.656 1.00 14.32 N ATOM 109 CE2 TRP A 8 -8.181 -1.589 -10.190 1.00 73.42 C ATOM 110 CE3 TRP A 8 -9.190 -2.445 -12.204 1.00 52.25 C ATOM 111 CZ2 TRP A 8 -8.056 -2.867 -9.661 1.00 11.11 C ATOM 112 CZ3 TRP A 8 -9.064 -3.716 -11.674 1.00 74.13 C ATOM 113 CH2 TRP A 8 -8.500 -3.913 -10.410 1.00 10.43 C ATOM 0 H TRP A 8 -9.736 2.099 -14.910 1.00 71.23 H new ATOM 0 HA TRP A 8 -7.535 2.124 -13.304 1.00 72.11 H new ATOM 0 HB2 TRP A 8 -9.845 1.625 -12.577 1.00 30.02 H new ATOM 0 HB3 TRP A 8 -9.841 0.120 -13.475 1.00 30.02 H new ATOM 0 HD1 TRP A 8 -7.985 1.669 -10.385 1.00 73.52 H new ATOM 0 HE1 TRP A 8 -7.405 -0.232 -8.741 1.00 14.32 H new ATOM 0 HE3 TRP A 8 -9.625 -2.298 -13.182 1.00 52.25 H new ATOM 0 HZ2 TRP A 8 -7.620 -3.026 -8.686 1.00 11.11 H new ATOM 0 HZ3 TRP A 8 -9.406 -4.567 -12.244 1.00 74.13 H new ATOM 0 HH2 TRP A 8 -8.415 -4.916 -10.020 1.00 10.43 H new ATOM 124 N GLU A 9 -7.597 -0.802 -14.920 1.00 23.30 N ATOM 125 CA GLU A 9 -6.765 -1.970 -15.300 1.00 75.11 C ATOM 126 C GLU A 9 -5.890 -1.685 -16.539 1.00 45.12 C ATOM 127 O GLU A 9 -4.955 -2.449 -16.824 1.00 73.22 O ATOM 128 CB GLU A 9 -7.635 -3.242 -15.502 1.00 62.53 C ATOM 129 CG GLU A 9 -8.700 -3.147 -16.609 1.00 44.42 C ATOM 130 CD GLU A 9 -9.602 -4.388 -16.703 1.00 71.52 C ATOM 131 OE1 GLU A 9 -10.412 -4.606 -15.779 1.00 52.15 O ATOM 132 OE2 GLU A 9 -9.501 -5.152 -17.687 1.00 62.01 O ATOM 0 H GLU A 9 -8.564 -0.860 -15.241 1.00 23.30 H new ATOM 0 HA GLU A 9 -6.085 -2.159 -14.469 1.00 75.11 H new ATOM 0 HB2 GLU A 9 -6.975 -4.080 -15.727 1.00 62.53 H new ATOM 0 HB3 GLU A 9 -8.134 -3.473 -14.561 1.00 62.53 H new ATOM 0 HG2 GLU A 9 -9.321 -2.269 -16.430 1.00 44.42 H new ATOM 0 HG3 GLU A 9 -8.203 -2.996 -17.567 1.00 44.42 H new ATOM 139 N THR A 10 -6.176 -0.578 -17.253 1.00 4.34 N ATOM 140 CA THR A 10 -5.365 -0.136 -18.396 1.00 64.11 C ATOM 141 C THR A 10 -4.040 0.467 -17.887 1.00 74.11 C ATOM 142 O THR A 10 -2.970 -0.010 -18.238 1.00 74.52 O ATOM 143 CB THR A 10 -6.125 0.910 -19.286 1.00 71.41 C ATOM 144 OG1 THR A 10 -7.425 0.409 -19.647 1.00 12.44 O ATOM 145 CG2 THR A 10 -5.342 1.252 -20.570 1.00 41.10 C ATOM 0 H THR A 10 -6.971 0.029 -17.052 1.00 4.34 H new ATOM 0 HA THR A 10 -5.161 -1.007 -19.019 1.00 64.11 H new ATOM 0 HB THR A 10 -6.227 1.819 -18.694 1.00 71.41 H new ATOM 0 HG1 THR A 10 -7.950 0.246 -18.835 1.00 12.44 H new ATOM 0 HG21 THR A 10 -5.904 1.979 -21.156 1.00 41.10 H new ATOM 0 HG22 THR A 10 -4.372 1.672 -20.304 1.00 41.10 H new ATOM 0 HG23 THR A 10 -5.196 0.347 -21.159 1.00 41.10 H new ATOM 153 N GLN A 11 -4.126 1.510 -17.039 1.00 41.42 N ATOM 154 CA GLN A 11 -2.937 2.127 -16.410 1.00 72.12 C ATOM 155 C GLN A 11 -2.213 1.129 -15.477 1.00 44.20 C ATOM 156 O GLN A 11 -0.990 1.188 -15.334 1.00 1.43 O ATOM 157 CB GLN A 11 -3.341 3.416 -15.642 1.00 61.22 C ATOM 158 CG GLN A 11 -4.222 3.189 -14.398 1.00 52.11 C ATOM 159 CD GLN A 11 -4.686 4.488 -13.735 1.00 12.24 C ATOM 160 OE1 GLN A 11 -4.019 5.024 -12.856 1.00 50.24 O ATOM 161 NE2 GLN A 11 -5.829 5.003 -14.150 1.00 74.11 N ATOM 0 H GLN A 11 -5.009 1.946 -16.772 1.00 41.42 H new ATOM 0 HA GLN A 11 -2.238 2.401 -17.200 1.00 72.12 H new ATOM 0 HB2 GLN A 11 -2.434 3.936 -15.335 1.00 61.22 H new ATOM 0 HB3 GLN A 11 -3.871 4.077 -16.327 1.00 61.22 H new ATOM 0 HG2 GLN A 11 -5.096 2.603 -14.683 1.00 52.11 H new ATOM 0 HG3 GLN A 11 -3.665 2.598 -13.671 1.00 52.11 H new ATOM 0 HE21 GLN A 11 -6.363 4.536 -14.883 1.00 74.11 H new ATOM 0 HE22 GLN A 11 -6.178 5.868 -13.738 1.00 74.11 H new ATOM 170 N LEU A 12 -3.000 0.205 -14.879 1.00 23.00 N ATOM 171 CA LEU A 12 -2.492 -0.843 -13.971 1.00 34.21 C ATOM 172 C LEU A 12 -1.434 -1.731 -14.650 1.00 22.52 C ATOM 173 O LEU A 12 -0.525 -2.204 -13.973 1.00 43.55 O ATOM 174 CB LEU A 12 -3.662 -1.715 -13.440 1.00 20.54 C ATOM 175 CG LEU A 12 -3.310 -2.842 -12.414 1.00 20.23 C ATOM 176 CD1 LEU A 12 -2.637 -2.270 -11.148 1.00 12.50 C ATOM 177 CD2 LEU A 12 -4.562 -3.686 -12.060 1.00 21.12 C ATOM 0 H LEU A 12 -4.010 0.168 -15.015 1.00 23.00 H new ATOM 0 HA LEU A 12 -2.011 -0.340 -13.133 1.00 34.21 H new ATOM 0 HB2 LEU A 12 -4.392 -1.052 -12.976 1.00 20.54 H new ATOM 0 HB3 LEU A 12 -4.152 -2.179 -14.296 1.00 20.54 H new ATOM 0 HG LEU A 12 -2.587 -3.505 -12.890 1.00 20.23 H new ATOM 0 HD11 LEU A 12 -2.408 -3.083 -10.459 1.00 12.50 H new ATOM 0 HD12 LEU A 12 -1.715 -1.758 -11.425 1.00 12.50 H new ATOM 0 HD13 LEU A 12 -3.312 -1.564 -10.664 1.00 12.50 H new ATOM 0 HD21 LEU A 12 -4.288 -4.462 -11.345 1.00 21.12 H new ATOM 0 HD22 LEU A 12 -5.323 -3.041 -11.621 1.00 21.12 H new ATOM 0 HD23 LEU A 12 -4.956 -4.149 -12.965 1.00 21.12 H new ATOM 189 N GLN A 13 -1.548 -1.936 -15.983 1.00 30.42 N ATOM 190 CA GLN A 13 -0.598 -2.782 -16.736 1.00 65.40 C ATOM 191 C GLN A 13 0.818 -2.157 -16.717 1.00 44.34 C ATOM 192 O GLN A 13 1.809 -2.873 -16.615 1.00 73.34 O ATOM 193 CB GLN A 13 -1.095 -3.034 -18.193 1.00 64.21 C ATOM 194 CG GLN A 13 -0.812 -1.895 -19.202 1.00 11.43 C ATOM 195 CD GLN A 13 -1.541 -2.019 -20.545 1.00 71.01 C ATOM 196 OE1 GLN A 13 -1.862 -1.015 -21.179 1.00 45.32 O ATOM 197 NE2 GLN A 13 -1.776 -3.238 -21.013 1.00 51.42 N ATOM 0 H GLN A 13 -2.287 -1.528 -16.556 1.00 30.42 H new ATOM 0 HA GLN A 13 -0.543 -3.753 -16.244 1.00 65.40 H new ATOM 0 HB2 GLN A 13 -0.630 -3.947 -18.564 1.00 64.21 H new ATOM 0 HB3 GLN A 13 -2.170 -3.212 -18.165 1.00 64.21 H new ATOM 0 HG2 GLN A 13 -1.089 -0.946 -18.742 1.00 11.43 H new ATOM 0 HG3 GLN A 13 0.261 -1.856 -19.391 1.00 11.43 H new ATOM 0 HE21 GLN A 13 -1.500 -4.055 -20.468 1.00 51.42 H new ATOM 0 HE22 GLN A 13 -2.232 -3.358 -21.917 1.00 51.42 H new ATOM 206 N ALA A 14 0.886 -0.812 -16.786 1.00 74.44 N ATOM 207 CA ALA A 14 2.157 -0.068 -16.753 1.00 32.20 C ATOM 208 C ALA A 14 2.718 -0.046 -15.324 1.00 30.24 C ATOM 209 O ALA A 14 3.920 -0.258 -15.108 1.00 53.12 O ATOM 210 CB ALA A 14 1.947 1.356 -17.284 1.00 5.15 C ATOM 0 H ALA A 14 0.063 -0.215 -16.866 1.00 74.44 H new ATOM 0 HA ALA A 14 2.882 -0.568 -17.396 1.00 32.20 H new ATOM 0 HB1 ALA A 14 2.892 1.898 -17.256 1.00 5.15 H new ATOM 0 HB2 ALA A 14 1.585 1.312 -18.311 1.00 5.15 H new ATOM 0 HB3 ALA A 14 1.214 1.872 -16.663 1.00 5.15 H new ATOM 216 N ASN A 15 1.806 0.213 -14.365 1.00 44.23 N ATOM 217 CA ASN A 15 2.101 0.224 -12.920 1.00 21.22 C ATOM 218 C ASN A 15 2.758 -1.088 -12.462 1.00 12.44 C ATOM 219 O ASN A 15 3.805 -1.067 -11.823 1.00 1.04 O ATOM 220 CB ASN A 15 0.800 0.475 -12.098 1.00 33.42 C ATOM 221 CG ASN A 15 0.209 1.881 -12.276 1.00 15.45 C ATOM 222 OD1 ASN A 15 0.452 2.555 -13.276 1.00 31.13 O ATOM 223 ND2 ASN A 15 -0.608 2.317 -11.327 1.00 23.35 N ATOM 0 H ASN A 15 0.831 0.423 -14.577 1.00 44.23 H new ATOM 0 HA ASN A 15 2.805 1.036 -12.741 1.00 21.22 H new ATOM 0 HB2 ASN A 15 0.051 -0.262 -12.389 1.00 33.42 H new ATOM 0 HB3 ASN A 15 1.013 0.313 -11.041 1.00 33.42 H new ATOM 0 HD21 ASN A 15 -1.052 3.231 -11.416 1.00 23.35 H new ATOM 0 HD22 ASN A 15 -0.793 1.738 -10.508 1.00 23.35 H new ATOM 230 N ARG A 16 2.142 -2.218 -12.836 1.00 74.41 N ATOM 231 CA ARG A 16 2.552 -3.556 -12.366 1.00 55.24 C ATOM 232 C ARG A 16 3.823 -4.047 -13.072 1.00 0.45 C ATOM 233 O ARG A 16 4.607 -4.788 -12.474 1.00 51.10 O ATOM 234 CB ARG A 16 1.422 -4.597 -12.583 1.00 15.54 C ATOM 235 CG ARG A 16 1.105 -4.925 -14.062 1.00 54.33 C ATOM 236 CD ARG A 16 0.174 -6.131 -14.234 1.00 54.33 C ATOM 237 NE ARG A 16 -1.089 -5.990 -13.489 1.00 33.22 N ATOM 238 CZ ARG A 16 -2.016 -6.954 -13.372 1.00 20.23 C ATOM 239 NH1 ARG A 16 -1.849 -8.141 -13.959 1.00 0.24 N ATOM 240 NH2 ARG A 16 -3.079 -6.746 -12.607 1.00 64.52 N ATOM 0 H ARG A 16 1.345 -2.234 -13.473 1.00 74.41 H new ATOM 0 HA ARG A 16 2.758 -3.458 -11.300 1.00 55.24 H new ATOM 0 HB2 ARG A 16 1.697 -5.520 -12.073 1.00 15.54 H new ATOM 0 HB3 ARG A 16 0.514 -4.229 -12.106 1.00 15.54 H new ATOM 0 HG2 ARG A 16 0.647 -4.053 -14.529 1.00 54.33 H new ATOM 0 HG3 ARG A 16 2.038 -5.118 -14.591 1.00 54.33 H new ATOM 0 HD2 ARG A 16 -0.047 -6.265 -15.293 1.00 54.33 H new ATOM 0 HD3 ARG A 16 0.689 -7.032 -13.900 1.00 54.33 H new ATOM 0 HE ARG A 16 -1.272 -5.098 -13.030 1.00 33.22 H new ATOM 0 HH11 ARG A 16 -1.008 -8.326 -14.506 1.00 0.24 H new ATOM 0 HH12 ARG A 16 -2.562 -8.863 -13.861 1.00 0.24 H new ATOM 0 HH21 ARG A 16 -3.187 -5.860 -12.114 1.00 64.52 H new ATOM 0 HH22 ARG A 16 -3.789 -7.472 -12.512 1.00 64.52 H new ATOM 254 N ASP A 17 4.010 -3.615 -14.340 1.00 31.55 N ATOM 255 CA ASP A 17 5.015 -4.196 -15.246 1.00 21.31 C ATOM 256 C ASP A 17 6.428 -4.015 -14.679 1.00 52.41 C ATOM 257 O ASP A 17 7.068 -4.985 -14.270 1.00 43.14 O ATOM 258 CB ASP A 17 4.894 -3.583 -16.665 1.00 4.35 C ATOM 259 CG ASP A 17 5.709 -4.349 -17.724 1.00 60.13 C ATOM 260 OD1 ASP A 17 5.195 -5.348 -18.277 1.00 14.31 O ATOM 261 OD2 ASP A 17 6.862 -3.968 -18.004 1.00 11.33 O ATOM 0 H ASP A 17 3.469 -2.858 -14.758 1.00 31.55 H new ATOM 0 HA ASP A 17 4.825 -5.266 -15.328 1.00 21.31 H new ATOM 0 HB2 ASP A 17 3.845 -3.571 -16.961 1.00 4.35 H new ATOM 0 HB3 ASP A 17 5.229 -2.546 -16.637 1.00 4.35 H new ATOM 266 N GLU A 18 6.883 -2.756 -14.614 1.00 41.24 N ATOM 267 CA GLU A 18 8.215 -2.431 -14.081 1.00 23.31 C ATOM 268 C GLU A 18 8.286 -2.575 -12.541 1.00 53.45 C ATOM 269 O GLU A 18 9.380 -2.594 -11.962 1.00 22.12 O ATOM 270 CB GLU A 18 8.654 -1.020 -14.521 1.00 11.34 C ATOM 271 CG GLU A 18 7.856 0.144 -13.908 1.00 53.42 C ATOM 272 CD GLU A 18 8.482 1.506 -14.233 1.00 45.44 C ATOM 273 OE1 GLU A 18 9.581 1.796 -13.713 1.00 43.21 O ATOM 274 OE2 GLU A 18 7.898 2.283 -15.024 1.00 3.24 O ATOM 0 H GLU A 18 6.348 -1.945 -14.924 1.00 41.24 H new ATOM 0 HA GLU A 18 8.910 -3.158 -14.501 1.00 23.31 H new ATOM 0 HB2 GLU A 18 9.706 -0.890 -14.266 1.00 11.34 H new ATOM 0 HB3 GLU A 18 8.579 -0.957 -15.607 1.00 11.34 H new ATOM 0 HG2 GLU A 18 6.832 0.118 -14.281 1.00 53.42 H new ATOM 0 HG3 GLU A 18 7.804 0.018 -12.827 1.00 53.42 H new ATOM 281 N LYS A 19 7.124 -2.684 -11.887 1.00 64.51 N ATOM 282 CA LYS A 19 7.044 -2.929 -10.436 1.00 21.51 C ATOM 283 C LYS A 19 7.483 -4.377 -10.127 1.00 41.23 C ATOM 284 O LYS A 19 8.146 -4.636 -9.120 1.00 65.22 O ATOM 285 CB LYS A 19 5.603 -2.659 -9.943 1.00 75.43 C ATOM 286 CG LYS A 19 5.419 -2.654 -8.415 1.00 34.45 C ATOM 287 CD LYS A 19 3.957 -2.390 -7.975 1.00 22.23 C ATOM 288 CE LYS A 19 3.409 -1.032 -8.455 1.00 15.11 C ATOM 289 NZ LYS A 19 4.270 0.097 -8.023 1.00 42.35 N ATOM 0 H LYS A 19 6.215 -2.606 -12.343 1.00 64.51 H new ATOM 0 HA LYS A 19 7.716 -2.253 -9.908 1.00 21.51 H new ATOM 0 HB2 LYS A 19 5.278 -1.695 -10.334 1.00 75.43 H new ATOM 0 HB3 LYS A 19 4.944 -3.415 -10.369 1.00 75.43 H new ATOM 0 HG2 LYS A 19 5.744 -3.614 -8.014 1.00 34.45 H new ATOM 0 HG3 LYS A 19 6.065 -1.891 -7.981 1.00 34.45 H new ATOM 0 HD2 LYS A 19 3.320 -3.187 -8.359 1.00 22.23 H new ATOM 0 HD3 LYS A 19 3.899 -2.433 -6.887 1.00 22.23 H new ATOM 0 HE2 LYS A 19 3.333 -1.035 -9.542 1.00 15.11 H new ATOM 0 HE3 LYS A 19 2.401 -0.889 -8.066 1.00 15.11 H new ATOM 0 HZ1 LYS A 19 3.966 0.968 -8.503 1.00 42.35 H new ATOM 0 HZ2 LYS A 19 4.188 0.222 -6.994 1.00 42.35 H new ATOM 0 HZ3 LYS A 19 5.260 -0.107 -8.269 1.00 42.35 H new ATOM 303 N ASP A 20 7.142 -5.308 -11.042 1.00 21.21 N ATOM 304 CA ASP A 20 7.530 -6.733 -10.935 1.00 34.30 C ATOM 305 C ASP A 20 9.058 -6.904 -11.026 1.00 20.11 C ATOM 306 O ASP A 20 9.653 -7.693 -10.274 1.00 11.51 O ATOM 307 CB ASP A 20 6.818 -7.580 -12.019 1.00 5.33 C ATOM 308 CG ASP A 20 7.230 -9.071 -12.012 1.00 50.14 C ATOM 309 OD1 ASP A 20 6.941 -9.773 -11.027 1.00 35.30 O ATOM 310 OD2 ASP A 20 7.844 -9.544 -12.990 1.00 35.32 O ATOM 0 H ASP A 20 6.592 -5.096 -11.874 1.00 21.21 H new ATOM 0 HA ASP A 20 7.212 -7.092 -9.956 1.00 34.30 H new ATOM 0 HB2 ASP A 20 5.740 -7.509 -11.873 1.00 5.33 H new ATOM 0 HB3 ASP A 20 7.035 -7.157 -13.000 1.00 5.33 H new ATOM 315 N ARG A 21 9.688 -6.119 -11.922 1.00 74.13 N ATOM 316 CA ARG A 21 11.148 -6.195 -12.152 1.00 51.42 C ATOM 317 C ARG A 21 11.912 -5.417 -11.072 1.00 4.00 C ATOM 318 O ARG A 21 13.115 -5.586 -10.934 1.00 31.21 O ATOM 319 CB ARG A 21 11.550 -5.677 -13.561 1.00 60.52 C ATOM 320 CG ARG A 21 11.473 -4.152 -13.730 1.00 43.23 C ATOM 321 CD ARG A 21 11.989 -3.646 -15.080 1.00 4.12 C ATOM 322 NE ARG A 21 11.921 -2.180 -15.157 1.00 54.53 N ATOM 323 CZ ARG A 21 11.900 -1.461 -16.291 1.00 20.31 C ATOM 324 NH1 ARG A 21 11.958 -2.060 -17.481 1.00 73.14 N ATOM 325 NH2 ARG A 21 11.793 -0.138 -16.225 1.00 43.05 N ATOM 0 H ARG A 21 9.211 -5.425 -12.498 1.00 74.13 H new ATOM 0 HA ARG A 21 11.420 -7.249 -12.096 1.00 51.42 H new ATOM 0 HB2 ARG A 21 12.568 -6.002 -13.776 1.00 60.52 H new ATOM 0 HB3 ARG A 21 10.903 -6.144 -14.303 1.00 60.52 H new ATOM 0 HG2 ARG A 21 10.437 -3.835 -13.607 1.00 43.23 H new ATOM 0 HG3 ARG A 21 12.047 -3.679 -12.933 1.00 43.23 H new ATOM 0 HD2 ARG A 21 13.018 -3.973 -15.225 1.00 4.12 H new ATOM 0 HD3 ARG A 21 11.399 -4.083 -15.885 1.00 4.12 H new ATOM 0 HE ARG A 21 11.887 -1.666 -14.276 1.00 54.53 H new ATOM 0 HH11 ARG A 21 12.019 -3.077 -17.538 1.00 73.14 H new ATOM 0 HH12 ARG A 21 11.941 -1.502 -18.334 1.00 73.14 H new ATOM 0 HH21 ARG A 21 11.728 0.324 -15.318 1.00 43.05 H new ATOM 0 HH22 ARG A 21 11.776 0.416 -17.081 1.00 43.05 H new ATOM 339 N PHE A 22 11.200 -4.541 -10.334 1.00 70.41 N ATOM 340 CA PHE A 22 11.779 -3.757 -9.226 1.00 71.22 C ATOM 341 C PHE A 22 12.395 -4.686 -8.150 1.00 54.14 C ATOM 342 O PHE A 22 13.516 -4.466 -7.706 1.00 71.20 O ATOM 343 CB PHE A 22 10.688 -2.836 -8.620 1.00 3.24 C ATOM 344 CG PHE A 22 11.190 -1.835 -7.578 1.00 63.23 C ATOM 345 CD1 PHE A 22 11.631 -0.568 -7.961 1.00 25.40 C ATOM 346 CD2 PHE A 22 11.216 -2.159 -6.222 1.00 13.24 C ATOM 347 CE1 PHE A 22 12.080 0.339 -7.022 1.00 25.33 C ATOM 348 CE2 PHE A 22 11.668 -1.252 -5.290 1.00 63.10 C ATOM 349 CZ PHE A 22 12.098 -0.005 -5.688 1.00 11.01 C ATOM 0 H PHE A 22 10.209 -4.358 -10.490 1.00 70.41 H new ATOM 0 HA PHE A 22 12.587 -3.136 -9.613 1.00 71.22 H new ATOM 0 HB2 PHE A 22 10.209 -2.285 -9.429 1.00 3.24 H new ATOM 0 HB3 PHE A 22 9.921 -3.460 -8.162 1.00 3.24 H new ATOM 0 HD1 PHE A 22 11.621 -0.293 -9.005 1.00 25.40 H new ATOM 0 HD2 PHE A 22 10.878 -3.133 -5.899 1.00 13.24 H new ATOM 0 HE1 PHE A 22 12.417 1.317 -7.333 1.00 25.33 H new ATOM 0 HE2 PHE A 22 11.686 -1.519 -4.244 1.00 63.10 H new ATOM 0 HZ PHE A 22 12.450 0.704 -4.953 1.00 11.01 H new ATOM 359 N PHE A 23 11.646 -5.733 -7.762 1.00 41.03 N ATOM 360 CA PHE A 23 12.121 -6.755 -6.793 1.00 24.03 C ATOM 361 C PHE A 23 13.174 -7.699 -7.411 1.00 14.33 C ATOM 362 O PHE A 23 13.932 -8.353 -6.685 1.00 0.13 O ATOM 363 CB PHE A 23 10.915 -7.591 -6.254 1.00 53.21 C ATOM 364 CG PHE A 23 10.085 -6.940 -5.135 1.00 35.40 C ATOM 365 CD1 PHE A 23 10.228 -5.588 -4.791 1.00 53.22 C ATOM 366 CD2 PHE A 23 9.165 -7.709 -4.406 1.00 52.41 C ATOM 367 CE1 PHE A 23 9.479 -5.033 -3.766 1.00 14.25 C ATOM 368 CE2 PHE A 23 8.423 -7.149 -3.380 1.00 23.03 C ATOM 369 CZ PHE A 23 8.578 -5.814 -3.063 1.00 75.01 C ATOM 0 H PHE A 23 10.700 -5.900 -8.104 1.00 41.03 H new ATOM 0 HA PHE A 23 12.596 -6.221 -5.970 1.00 24.03 H new ATOM 0 HB2 PHE A 23 10.251 -7.812 -7.089 1.00 53.21 H new ATOM 0 HB3 PHE A 23 11.295 -8.545 -5.888 1.00 53.21 H new ATOM 0 HD1 PHE A 23 10.931 -4.972 -5.332 1.00 53.22 H new ATOM 0 HD2 PHE A 23 9.034 -8.753 -4.649 1.00 52.41 H new ATOM 0 HE1 PHE A 23 9.598 -3.989 -3.515 1.00 14.25 H new ATOM 0 HE2 PHE A 23 7.722 -7.757 -2.827 1.00 23.03 H new ATOM 0 HZ PHE A 23 7.995 -5.378 -2.265 1.00 75.01 H new ATOM 379 N SER A 24 13.203 -7.771 -8.746 1.00 42.23 N ATOM 380 CA SER A 24 14.000 -8.768 -9.484 1.00 64.52 C ATOM 381 C SER A 24 15.357 -8.201 -9.948 1.00 51.34 C ATOM 382 O SER A 24 16.344 -8.942 -10.043 1.00 75.42 O ATOM 383 CB SER A 24 13.172 -9.258 -10.688 1.00 34.42 C ATOM 384 OG SER A 24 11.886 -9.691 -10.266 1.00 11.41 O ATOM 0 H SER A 24 12.675 -7.141 -9.350 1.00 42.23 H new ATOM 0 HA SER A 24 14.227 -9.600 -8.817 1.00 64.52 H new ATOM 0 HB2 SER A 24 13.070 -8.455 -11.418 1.00 34.42 H new ATOM 0 HB3 SER A 24 13.692 -10.076 -11.186 1.00 34.42 H new ATOM 0 HG SER A 24 11.256 -8.942 -10.316 1.00 11.41 H new ATOM 390 N GLU A 25 15.399 -6.886 -10.228 1.00 12.02 N ATOM 391 CA GLU A 25 16.539 -6.235 -10.910 1.00 0.22 C ATOM 392 C GLU A 25 17.065 -5.055 -10.075 1.00 73.12 C ATOM 393 O GLU A 25 18.261 -4.995 -9.758 1.00 71.03 O ATOM 394 CB GLU A 25 16.118 -5.735 -12.328 1.00 51.22 C ATOM 395 CG GLU A 25 15.419 -6.797 -13.212 1.00 72.54 C ATOM 396 CD GLU A 25 15.083 -6.340 -14.647 1.00 54.45 C ATOM 397 OE1 GLU A 25 15.036 -5.122 -14.919 1.00 51.14 O ATOM 398 OE2 GLU A 25 14.843 -7.210 -15.513 1.00 4.54 O ATOM 0 H GLU A 25 14.645 -6.242 -9.989 1.00 12.02 H new ATOM 0 HA GLU A 25 17.334 -6.972 -11.019 1.00 0.22 H new ATOM 0 HB2 GLU A 25 15.449 -4.882 -12.213 1.00 51.22 H new ATOM 0 HB3 GLU A 25 17.006 -5.376 -12.849 1.00 51.22 H new ATOM 0 HG2 GLU A 25 16.059 -7.677 -13.269 1.00 72.54 H new ATOM 0 HG3 GLU A 25 14.496 -7.105 -12.721 1.00 72.54 H new ATOM 405 N HIS A 26 16.154 -4.127 -9.711 1.00 1.51 N ATOM 406 CA HIS A 26 16.526 -2.844 -9.070 1.00 34.13 C ATOM 407 C HIS A 26 17.028 -3.080 -7.636 1.00 64.14 C ATOM 408 O HIS A 26 18.182 -2.796 -7.315 1.00 43.12 O ATOM 409 CB HIS A 26 15.325 -1.859 -9.074 1.00 11.42 C ATOM 410 CG HIS A 26 15.597 -0.551 -8.369 1.00 1.44 C ATOM 411 ND1 HIS A 26 15.274 -0.383 -7.048 1.00 11.22 N ATOM 412 CD2 HIS A 26 16.176 0.589 -8.825 1.00 14.22 C ATOM 413 CE1 HIS A 26 15.659 0.833 -6.724 1.00 24.50 C ATOM 414 NE2 HIS A 26 16.212 1.465 -7.767 1.00 30.01 N ATOM 0 H HIS A 26 15.150 -4.242 -9.851 1.00 1.51 H new ATOM 0 HA HIS A 26 17.336 -2.397 -9.647 1.00 34.13 H new ATOM 0 HB2 HIS A 26 15.043 -1.651 -10.106 1.00 11.42 H new ATOM 0 HB3 HIS A 26 14.470 -2.343 -8.601 1.00 11.42 H new ATOM 0 HD2 HIS A 26 16.538 0.772 -9.826 1.00 14.22 H new ATOM 0 HE1 HIS A 26 15.544 1.266 -5.741 1.00 24.50 H new ATOM 0 HE2 HIS A 26 16.587 2.413 -7.775 1.00 30.01 H new ATOM 422 N ARG A 27 16.142 -3.597 -6.791 1.00 71.22 N ATOM 423 CA ARG A 27 16.455 -3.955 -5.402 1.00 74.03 C ATOM 424 C ARG A 27 16.652 -5.462 -5.281 1.00 51.44 C ATOM 425 O ARG A 27 16.089 -6.233 -6.073 1.00 14.10 O ATOM 426 CB ARG A 27 15.326 -3.485 -4.442 1.00 20.20 C ATOM 427 CG ARG A 27 15.265 -1.965 -4.212 1.00 31.31 C ATOM 428 CD ARG A 27 16.596 -1.395 -3.683 1.00 45.41 C ATOM 429 NE ARG A 27 17.067 -2.109 -2.474 1.00 51.11 N ATOM 430 CZ ARG A 27 18.280 -1.982 -1.920 1.00 23.51 C ATOM 431 NH1 ARG A 27 19.187 -1.160 -2.438 1.00 30.43 N ATOM 432 NH2 ARG A 27 18.579 -2.682 -0.825 1.00 55.13 N ATOM 0 H ARG A 27 15.173 -3.783 -7.050 1.00 71.22 H new ATOM 0 HA ARG A 27 17.379 -3.451 -5.118 1.00 74.03 H new ATOM 0 HB2 ARG A 27 14.368 -3.816 -4.841 1.00 20.20 H new ATOM 0 HB3 ARG A 27 15.458 -3.979 -3.479 1.00 20.20 H new ATOM 0 HG2 ARG A 27 15.007 -1.469 -5.148 1.00 31.31 H new ATOM 0 HG3 ARG A 27 14.469 -1.740 -3.502 1.00 31.31 H new ATOM 0 HD2 ARG A 27 17.355 -1.464 -4.463 1.00 45.41 H new ATOM 0 HD3 ARG A 27 16.471 -0.337 -3.453 1.00 45.41 H new ATOM 0 HE ARG A 27 16.413 -2.751 -2.026 1.00 51.11 H new ATOM 0 HH11 ARG A 27 18.964 -0.614 -3.270 1.00 30.43 H new ATOM 0 HH12 ARG A 27 20.106 -1.075 -2.003 1.00 30.43 H new ATOM 0 HH21 ARG A 27 17.886 -3.309 -0.415 1.00 55.13 H new ATOM 0 HH22 ARG A 27 19.500 -2.591 -0.397 1.00 55.13 H new ATOM 446 N GLN A 28 17.479 -5.865 -4.296 1.00 31.22 N ATOM 447 CA GLN A 28 17.655 -7.276 -3.916 1.00 53.12 C ATOM 448 C GLN A 28 16.302 -7.888 -3.515 1.00 33.25 C ATOM 449 O GLN A 28 15.447 -7.183 -2.942 1.00 1.55 O ATOM 450 CB GLN A 28 18.687 -7.400 -2.760 1.00 2.14 C ATOM 451 CG GLN A 28 18.290 -6.679 -1.458 1.00 63.52 C ATOM 452 CD GLN A 28 19.386 -6.705 -0.388 1.00 4.21 C ATOM 453 OE1 GLN A 28 19.458 -7.628 0.423 1.00 1.41 O ATOM 454 NE2 GLN A 28 20.240 -5.691 -0.379 1.00 31.12 N ATOM 0 H GLN A 28 18.043 -5.219 -3.743 1.00 31.22 H new ATOM 0 HA GLN A 28 18.040 -7.829 -4.773 1.00 53.12 H new ATOM 0 HB2 GLN A 28 18.841 -8.457 -2.541 1.00 2.14 H new ATOM 0 HB3 GLN A 28 19.643 -7.003 -3.101 1.00 2.14 H new ATOM 0 HG2 GLN A 28 18.041 -5.643 -1.687 1.00 63.52 H new ATOM 0 HG3 GLN A 28 17.389 -7.142 -1.056 1.00 63.52 H new ATOM 0 HE21 GLN A 28 20.151 -4.943 -1.066 1.00 31.12 H new ATOM 0 HE22 GLN A 28 20.987 -5.659 0.315 1.00 31.12 H new ATOM 463 N SER A 29 16.112 -9.174 -3.863 1.00 12.00 N ATOM 464 CA SER A 29 14.857 -9.900 -3.634 1.00 53.24 C ATOM 465 C SER A 29 14.406 -9.806 -2.148 1.00 51.43 C ATOM 466 O SER A 29 15.149 -10.213 -1.258 1.00 3.31 O ATOM 467 CB SER A 29 15.051 -11.381 -4.036 1.00 53.13 C ATOM 468 OG SER A 29 15.546 -11.494 -5.362 1.00 61.43 O ATOM 0 H SER A 29 16.832 -9.739 -4.314 1.00 12.00 H new ATOM 0 HA SER A 29 14.076 -9.445 -4.244 1.00 53.24 H new ATOM 0 HB2 SER A 29 15.744 -11.860 -3.345 1.00 53.13 H new ATOM 0 HB3 SER A 29 14.102 -11.910 -3.953 1.00 53.13 H new ATOM 0 HG SER A 29 15.661 -12.440 -5.589 1.00 61.43 H new ATOM 474 N PRO A 30 13.198 -9.215 -1.869 1.00 0.03 N ATOM 475 CA PRO A 30 12.532 -9.314 -0.547 1.00 2.23 C ATOM 476 C PRO A 30 11.947 -10.705 -0.337 1.00 54.13 C ATOM 477 O PRO A 30 11.780 -11.156 0.795 1.00 32.02 O ATOM 478 CB PRO A 30 11.417 -8.230 -0.614 1.00 60.31 C ATOM 479 CG PRO A 30 11.789 -7.380 -1.792 1.00 74.25 C ATOM 480 CD PRO A 30 12.437 -8.325 -2.769 1.00 62.12 C ATOM 0 HA PRO A 30 13.215 -9.157 0.288 1.00 2.23 H new ATOM 0 HB2 PRO A 30 10.433 -8.680 -0.745 1.00 60.31 H new ATOM 0 HB3 PRO A 30 11.379 -7.642 0.303 1.00 60.31 H new ATOM 0 HG2 PRO A 30 10.911 -6.904 -2.228 1.00 74.25 H new ATOM 0 HG3 PRO A 30 12.473 -6.582 -1.502 1.00 74.25 H new ATOM 0 HD2 PRO A 30 11.701 -8.872 -3.358 1.00 62.12 H new ATOM 0 HD3 PRO A 30 13.086 -7.804 -3.473 1.00 62.12 H new ATOM 488 N ILE A 31 11.566 -11.334 -1.457 1.00 23.13 N ATOM 489 CA ILE A 31 11.198 -12.745 -1.516 1.00 35.01 C ATOM 490 C ILE A 31 12.514 -13.570 -1.618 1.00 73.12 C ATOM 491 O ILE A 31 13.093 -13.659 -2.705 1.00 41.53 O ATOM 492 CB ILE A 31 10.252 -13.023 -2.758 1.00 24.21 C ATOM 493 CG1 ILE A 31 9.160 -11.908 -2.910 1.00 62.20 C ATOM 494 CG2 ILE A 31 9.594 -14.417 -2.673 1.00 72.21 C ATOM 495 CD1 ILE A 31 8.249 -11.706 -1.705 1.00 10.51 C ATOM 0 H ILE A 31 11.506 -10.864 -2.360 1.00 23.13 H new ATOM 0 HA ILE A 31 10.644 -13.034 -0.623 1.00 35.01 H new ATOM 0 HB ILE A 31 10.883 -13.003 -3.647 1.00 24.21 H new ATOM 0 HG12 ILE A 31 9.659 -10.964 -3.127 1.00 62.20 H new ATOM 0 HG13 ILE A 31 8.541 -12.147 -3.774 1.00 62.20 H new ATOM 0 HG21 ILE A 31 8.953 -14.571 -3.541 1.00 72.21 H new ATOM 0 HG22 ILE A 31 10.368 -15.184 -2.653 1.00 72.21 H new ATOM 0 HG23 ILE A 31 8.995 -14.482 -1.764 1.00 72.21 H new ATOM 0 HD11 ILE A 31 7.533 -10.912 -1.919 1.00 10.51 H new ATOM 0 HD12 ILE A 31 7.713 -12.631 -1.495 1.00 10.51 H new ATOM 0 HD13 ILE A 31 8.849 -11.429 -0.838 1.00 10.51 H new ATOM 507 N PRO A 32 13.024 -14.147 -0.481 1.00 34.23 N ATOM 508 CA PRO A 32 14.384 -14.757 -0.407 1.00 73.10 C ATOM 509 C PRO A 32 14.509 -16.060 -1.231 1.00 45.21 C ATOM 510 O PRO A 32 13.481 -16.616 -1.623 1.00 21.52 O ATOM 511 CB PRO A 32 14.551 -15.018 1.115 1.00 11.21 C ATOM 512 CG PRO A 32 13.166 -15.237 1.609 1.00 3.32 C ATOM 513 CD PRO A 32 12.308 -14.282 0.814 1.00 52.34 C ATOM 0 HA PRO A 32 15.156 -14.115 -0.831 1.00 73.10 H new ATOM 0 HB2 PRO A 32 15.181 -15.887 1.302 1.00 11.21 H new ATOM 0 HB3 PRO A 32 15.021 -14.170 1.614 1.00 11.21 H new ATOM 0 HG2 PRO A 32 12.852 -16.269 1.456 1.00 3.32 H new ATOM 0 HG3 PRO A 32 13.093 -15.036 2.678 1.00 3.32 H new ATOM 0 HD2 PRO A 32 11.300 -14.673 0.674 1.00 52.34 H new ATOM 0 HD3 PRO A 32 12.209 -13.320 1.318 1.00 52.34 H new ATOM 521 N PRO A 33 15.779 -16.560 -1.496 1.00 53.54 N ATOM 522 CA PRO A 33 16.059 -17.777 -2.316 1.00 5.53 C ATOM 523 C PRO A 33 15.070 -18.948 -2.116 1.00 64.14 C ATOM 524 O PRO A 33 14.652 -19.598 -3.084 1.00 54.32 O ATOM 525 CB PRO A 33 17.466 -18.186 -1.835 1.00 13.23 C ATOM 526 CG PRO A 33 18.150 -16.901 -1.480 1.00 44.32 C ATOM 527 CD PRO A 33 17.064 -15.936 -1.035 1.00 2.44 C ATOM 0 HA PRO A 33 15.968 -17.554 -3.379 1.00 5.53 H new ATOM 0 HB2 PRO A 33 17.409 -18.853 -0.974 1.00 13.23 H new ATOM 0 HB3 PRO A 33 18.009 -18.719 -2.615 1.00 13.23 H new ATOM 0 HG2 PRO A 33 18.878 -17.057 -0.684 1.00 44.32 H new ATOM 0 HG3 PRO A 33 18.694 -16.503 -2.336 1.00 44.32 H new ATOM 0 HD2 PRO A 33 17.073 -15.803 0.047 1.00 2.44 H new ATOM 0 HD3 PRO A 33 17.206 -14.950 -1.478 1.00 2.44 H new ATOM 535 N GLU A 34 14.690 -19.170 -0.846 1.00 34.34 N ATOM 536 CA GLU A 34 13.801 -20.270 -0.443 1.00 63.32 C ATOM 537 C GLU A 34 12.373 -20.047 -0.974 1.00 22.41 C ATOM 538 O GLU A 34 11.803 -20.916 -1.643 1.00 41.03 O ATOM 539 CB GLU A 34 13.800 -20.380 1.107 1.00 52.02 C ATOM 540 CG GLU A 34 15.201 -20.608 1.723 1.00 51.24 C ATOM 541 CD GLU A 34 15.215 -20.557 3.261 1.00 62.10 C ATOM 542 OE1 GLU A 34 14.827 -21.551 3.905 1.00 23.31 O ATOM 543 OE2 GLU A 34 15.598 -19.514 3.833 1.00 65.10 O ATOM 0 H GLU A 34 14.994 -18.587 -0.066 1.00 34.34 H new ATOM 0 HA GLU A 34 14.168 -21.202 -0.872 1.00 63.32 H new ATOM 0 HB2 GLU A 34 13.375 -19.468 1.525 1.00 52.02 H new ATOM 0 HB3 GLU A 34 13.147 -21.201 1.402 1.00 52.02 H new ATOM 0 HG2 GLU A 34 15.579 -21.577 1.397 1.00 51.24 H new ATOM 0 HG3 GLU A 34 15.886 -19.853 1.337 1.00 51.24 H new ATOM 550 N GLU A 35 11.819 -18.859 -0.689 1.00 62.05 N ATOM 551 CA GLU A 35 10.451 -18.496 -1.082 1.00 2.23 C ATOM 552 C GLU A 35 10.296 -18.398 -2.607 1.00 21.12 C ATOM 553 O GLU A 35 9.439 -19.071 -3.185 1.00 32.34 O ATOM 554 CB GLU A 35 10.043 -17.170 -0.403 1.00 43.20 C ATOM 555 CG GLU A 35 10.159 -17.182 1.130 1.00 3.34 C ATOM 556 CD GLU A 35 9.328 -18.277 1.806 1.00 11.52 C ATOM 557 OE1 GLU A 35 8.082 -18.194 1.774 1.00 13.51 O ATOM 558 OE2 GLU A 35 9.917 -19.222 2.383 1.00 33.12 O ATOM 0 H GLU A 35 12.308 -18.123 -0.179 1.00 62.05 H new ATOM 0 HA GLU A 35 9.785 -19.290 -0.746 1.00 2.23 H new ATOM 0 HB2 GLU A 35 10.666 -16.367 -0.797 1.00 43.20 H new ATOM 0 HB3 GLU A 35 9.014 -16.937 -0.676 1.00 43.20 H new ATOM 0 HG2 GLU A 35 11.206 -17.312 1.404 1.00 3.34 H new ATOM 0 HG3 GLU A 35 9.847 -16.212 1.516 1.00 3.34 H new ATOM 565 N ARG A 36 11.175 -17.613 -3.261 1.00 55.13 N ATOM 566 CA ARG A 36 11.073 -17.320 -4.708 1.00 44.34 C ATOM 567 C ARG A 36 11.362 -18.554 -5.595 1.00 2.24 C ATOM 568 O ARG A 36 11.292 -18.456 -6.823 1.00 42.01 O ATOM 569 CB ARG A 36 12.028 -16.158 -5.095 1.00 5.21 C ATOM 570 CG ARG A 36 13.517 -16.474 -4.880 1.00 43.25 C ATOM 571 CD ARG A 36 14.452 -15.324 -5.290 1.00 51.13 C ATOM 572 NE ARG A 36 14.413 -15.057 -6.744 1.00 53.15 N ATOM 573 CZ ARG A 36 15.405 -15.328 -7.616 1.00 42.12 C ATOM 574 NH1 ARG A 36 16.541 -15.895 -7.214 1.00 12.22 N ATOM 575 NH2 ARG A 36 15.245 -15.034 -8.897 1.00 2.00 N ATOM 0 H ARG A 36 11.971 -17.166 -2.806 1.00 55.13 H new ATOM 0 HA ARG A 36 10.040 -17.026 -4.892 1.00 44.34 H new ATOM 0 HB2 ARG A 36 11.869 -15.904 -6.143 1.00 5.21 H new ATOM 0 HB3 ARG A 36 11.766 -15.276 -4.510 1.00 5.21 H new ATOM 0 HG2 ARG A 36 13.682 -16.709 -3.829 1.00 43.25 H new ATOM 0 HG3 ARG A 36 13.778 -17.365 -5.451 1.00 43.25 H new ATOM 0 HD2 ARG A 36 14.170 -14.420 -4.750 1.00 51.13 H new ATOM 0 HD3 ARG A 36 15.473 -15.567 -4.995 1.00 51.13 H new ATOM 0 HE ARG A 36 13.565 -14.632 -7.119 1.00 53.15 H new ATOM 0 HH11 ARG A 36 16.672 -16.132 -6.231 1.00 12.22 H new ATOM 0 HH12 ARG A 36 17.280 -16.092 -7.889 1.00 12.22 H new ATOM 0 HH21 ARG A 36 14.376 -14.606 -9.217 1.00 2.00 H new ATOM 0 HH22 ARG A 36 15.990 -15.236 -9.563 1.00 2.00 H new ATOM 589 N ASP A 37 11.705 -19.694 -4.973 1.00 44.43 N ATOM 590 CA ASP A 37 11.846 -20.972 -5.684 1.00 73.00 C ATOM 591 C ASP A 37 10.471 -21.458 -6.190 1.00 14.31 C ATOM 592 O ASP A 37 10.354 -21.928 -7.329 1.00 24.41 O ATOM 593 CB ASP A 37 12.515 -22.027 -4.766 1.00 15.42 C ATOM 594 CG ASP A 37 12.786 -23.368 -5.474 1.00 70.35 C ATOM 595 OD1 ASP A 37 13.510 -23.371 -6.493 1.00 42.31 O ATOM 596 OD2 ASP A 37 12.276 -24.415 -5.035 1.00 40.04 O ATOM 0 H ASP A 37 11.891 -19.754 -3.972 1.00 44.43 H new ATOM 0 HA ASP A 37 12.490 -20.826 -6.552 1.00 73.00 H new ATOM 0 HB2 ASP A 37 13.456 -21.626 -4.390 1.00 15.42 H new ATOM 0 HB3 ASP A 37 11.875 -22.204 -3.901 1.00 15.42 H new ATOM 601 N ASP A 38 9.433 -21.332 -5.340 1.00 44.01 N ATOM 602 CA ASP A 38 8.041 -21.669 -5.726 1.00 41.20 C ATOM 603 C ASP A 38 7.250 -20.410 -6.114 1.00 62.22 C ATOM 604 O ASP A 38 6.397 -20.462 -7.007 1.00 61.31 O ATOM 605 CB ASP A 38 7.301 -22.388 -4.576 1.00 71.25 C ATOM 606 CG ASP A 38 8.024 -23.643 -4.065 1.00 65.42 C ATOM 607 OD1 ASP A 38 8.129 -24.630 -4.814 1.00 12.20 O ATOM 608 OD2 ASP A 38 8.498 -23.637 -2.909 1.00 34.32 O ATOM 0 H ASP A 38 9.528 -20.999 -4.380 1.00 44.01 H new ATOM 0 HA ASP A 38 8.104 -22.334 -6.587 1.00 41.20 H new ATOM 0 HB2 ASP A 38 7.172 -21.691 -3.748 1.00 71.25 H new ATOM 0 HB3 ASP A 38 6.304 -22.667 -4.916 1.00 71.25 H new ATOM 613 N PHE A 39 7.530 -19.293 -5.424 1.00 20.13 N ATOM 614 CA PHE A 39 6.860 -18.004 -5.678 1.00 24.30 C ATOM 615 C PHE A 39 7.553 -17.269 -6.831 1.00 34.04 C ATOM 616 O PHE A 39 8.767 -17.355 -6.991 1.00 52.45 O ATOM 617 CB PHE A 39 6.858 -17.111 -4.402 1.00 43.05 C ATOM 618 CG PHE A 39 6.040 -17.671 -3.234 1.00 65.23 C ATOM 619 CD1 PHE A 39 4.653 -17.784 -3.328 1.00 33.15 C ATOM 620 CD2 PHE A 39 6.651 -18.081 -2.046 1.00 30.25 C ATOM 621 CE1 PHE A 39 3.909 -18.286 -2.277 1.00 74.15 C ATOM 622 CE2 PHE A 39 5.907 -18.583 -0.996 1.00 50.33 C ATOM 623 CZ PHE A 39 4.537 -18.685 -1.112 1.00 42.14 C ATOM 0 H PHE A 39 8.224 -19.256 -4.677 1.00 20.13 H new ATOM 0 HA PHE A 39 5.825 -18.208 -5.952 1.00 24.30 H new ATOM 0 HB2 PHE A 39 7.887 -16.968 -4.072 1.00 43.05 H new ATOM 0 HB3 PHE A 39 6.468 -16.127 -4.663 1.00 43.05 H new ATOM 0 HD1 PHE A 39 4.154 -17.475 -4.234 1.00 33.15 H new ATOM 0 HD2 PHE A 39 7.724 -18.004 -1.947 1.00 30.25 H new ATOM 0 HE1 PHE A 39 2.836 -18.367 -2.366 1.00 74.15 H new ATOM 0 HE2 PHE A 39 6.398 -18.895 -0.086 1.00 50.33 H new ATOM 0 HZ PHE A 39 3.954 -19.077 -0.292 1.00 42.14 H new ATOM 633 N ASP A 40 6.769 -16.552 -7.635 1.00 31.45 N ATOM 634 CA ASP A 40 7.280 -15.684 -8.712 1.00 72.51 C ATOM 635 C ASP A 40 7.607 -14.290 -8.129 1.00 12.11 C ATOM 636 O ASP A 40 7.430 -14.081 -6.916 1.00 72.14 O ATOM 637 CB ASP A 40 6.286 -15.616 -9.902 1.00 15.42 C ATOM 638 CG ASP A 40 5.091 -14.676 -9.689 1.00 70.14 C ATOM 639 OD1 ASP A 40 4.223 -14.974 -8.842 1.00 13.14 O ATOM 640 OD2 ASP A 40 5.025 -13.626 -10.366 1.00 23.13 O ATOM 0 H ASP A 40 5.752 -16.553 -7.562 1.00 31.45 H new ATOM 0 HA ASP A 40 8.200 -16.107 -9.116 1.00 72.51 H new ATOM 0 HB2 ASP A 40 6.828 -15.296 -10.792 1.00 15.42 H new ATOM 0 HB3 ASP A 40 5.910 -16.620 -10.101 1.00 15.42 H new ATOM 645 N GLY A 41 8.208 -13.410 -8.960 1.00 31.40 N ATOM 646 CA GLY A 41 8.514 -11.999 -8.604 1.00 11.15 C ATOM 647 C GLY A 41 7.371 -11.186 -7.946 1.00 53.33 C ATOM 648 O GLY A 41 6.510 -11.734 -7.247 1.00 32.43 O ATOM 0 H GLY A 41 8.498 -13.657 -9.906 1.00 31.40 H new ATOM 0 HA2 GLY A 41 9.368 -11.996 -7.926 1.00 11.15 H new ATOM 0 HA3 GLY A 41 8.824 -11.479 -9.510 1.00 11.15 H new ATOM 652 N LEU A 42 7.367 -9.849 -8.149 1.00 51.02 N ATOM 653 CA LEU A 42 6.415 -8.967 -7.437 1.00 3.14 C ATOM 654 C LEU A 42 5.032 -9.123 -8.088 1.00 13.41 C ATOM 655 O LEU A 42 4.690 -8.426 -9.049 1.00 51.31 O ATOM 656 CB LEU A 42 6.873 -7.472 -7.401 1.00 32.54 C ATOM 657 CG LEU A 42 6.250 -6.542 -6.274 1.00 3.13 C ATOM 658 CD1 LEU A 42 6.910 -5.152 -6.279 1.00 62.35 C ATOM 659 CD2 LEU A 42 4.711 -6.397 -6.355 1.00 51.13 C ATOM 0 H LEU A 42 7.999 -9.365 -8.787 1.00 51.02 H new ATOM 0 HA LEU A 42 6.372 -9.273 -6.392 1.00 3.14 H new ATOM 0 HB2 LEU A 42 7.957 -7.455 -7.290 1.00 32.54 H new ATOM 0 HB3 LEU A 42 6.644 -7.027 -8.369 1.00 32.54 H new ATOM 0 HG LEU A 42 6.463 -7.048 -5.333 1.00 3.13 H new ATOM 0 HD11 LEU A 42 6.465 -4.535 -5.498 1.00 62.35 H new ATOM 0 HD12 LEU A 42 7.979 -5.256 -6.094 1.00 62.35 H new ATOM 0 HD13 LEU A 42 6.754 -4.679 -7.248 1.00 62.35 H new ATOM 0 HD21 LEU A 42 4.364 -5.747 -5.552 1.00 51.13 H new ATOM 0 HD22 LEU A 42 4.437 -5.963 -7.317 1.00 51.13 H new ATOM 0 HD23 LEU A 42 4.247 -7.378 -6.254 1.00 51.13 H new ATOM 671 N SER A 43 4.276 -10.093 -7.578 1.00 33.34 N ATOM 672 CA SER A 43 2.842 -10.200 -7.792 1.00 53.44 C ATOM 673 C SER A 43 2.166 -9.842 -6.481 1.00 51.14 C ATOM 674 O SER A 43 2.612 -10.265 -5.399 1.00 54.33 O ATOM 675 CB SER A 43 2.431 -11.612 -8.242 1.00 45.12 C ATOM 676 OG SER A 43 3.025 -11.935 -9.473 1.00 73.25 O ATOM 0 H SER A 43 4.654 -10.839 -6.994 1.00 33.34 H new ATOM 0 HA SER A 43 2.538 -9.523 -8.591 1.00 53.44 H new ATOM 0 HB2 SER A 43 2.728 -12.340 -7.487 1.00 45.12 H new ATOM 0 HB3 SER A 43 1.346 -11.669 -8.330 1.00 45.12 H new ATOM 0 HG SER A 43 3.795 -12.521 -9.321 1.00 73.25 H new ATOM 682 N TYR A 44 1.098 -9.074 -6.571 1.00 61.33 N ATOM 683 CA TYR A 44 0.314 -8.649 -5.413 1.00 13.33 C ATOM 684 C TYR A 44 -0.971 -9.495 -5.340 1.00 3.52 C ATOM 685 O TYR A 44 -1.092 -10.511 -6.048 1.00 4.24 O ATOM 686 CB TYR A 44 0.039 -7.113 -5.506 1.00 32.10 C ATOM 687 CG TYR A 44 -0.299 -6.578 -6.916 1.00 41.33 C ATOM 688 CD1 TYR A 44 -1.518 -6.865 -7.515 1.00 13.52 C ATOM 689 CD2 TYR A 44 0.608 -5.799 -7.648 1.00 34.41 C ATOM 690 CE1 TYR A 44 -1.832 -6.415 -8.774 1.00 50.03 C ATOM 691 CE2 TYR A 44 0.293 -5.337 -8.914 1.00 63.13 C ATOM 692 CZ TYR A 44 -0.931 -5.654 -9.471 1.00 75.50 C ATOM 693 OH TYR A 44 -1.246 -5.223 -10.736 1.00 31.34 O ATOM 0 H TYR A 44 0.741 -8.720 -7.458 1.00 61.33 H new ATOM 0 HA TYR A 44 0.861 -8.814 -4.485 1.00 13.33 H new ATOM 0 HB2 TYR A 44 -0.786 -6.869 -4.837 1.00 32.10 H new ATOM 0 HB3 TYR A 44 0.916 -6.582 -5.136 1.00 32.10 H new ATOM 0 HD1 TYR A 44 -2.240 -7.459 -6.975 1.00 13.52 H new ATOM 0 HD2 TYR A 44 1.568 -5.555 -7.217 1.00 34.41 H new ATOM 0 HE1 TYR A 44 -2.787 -6.661 -9.214 1.00 50.03 H new ATOM 0 HE2 TYR A 44 1.000 -4.732 -9.463 1.00 63.13 H new ATOM 0 HH TYR A 44 -2.211 -5.060 -10.795 1.00 31.34 H new ATOM 703 N PHE A 45 -1.871 -9.114 -4.426 1.00 14.24 N ATOM 704 CA PHE A 45 -3.233 -9.663 -4.363 1.00 11.23 C ATOM 705 C PHE A 45 -3.867 -9.570 -5.764 1.00 52.30 C ATOM 706 O PHE A 45 -3.800 -8.516 -6.392 1.00 1.54 O ATOM 707 CB PHE A 45 -4.090 -8.889 -3.314 1.00 43.42 C ATOM 708 CG PHE A 45 -3.802 -9.199 -1.842 1.00 62.34 C ATOM 709 CD1 PHE A 45 -2.607 -9.796 -1.425 1.00 42.42 C ATOM 710 CD2 PHE A 45 -4.741 -8.869 -0.867 1.00 70.24 C ATOM 711 CE1 PHE A 45 -2.368 -10.046 -0.088 1.00 10.24 C ATOM 712 CE2 PHE A 45 -4.503 -9.122 0.467 1.00 31.43 C ATOM 713 CZ PHE A 45 -3.316 -9.710 0.858 1.00 64.23 C ATOM 0 H PHE A 45 -1.677 -8.416 -3.708 1.00 14.24 H new ATOM 0 HA PHE A 45 -3.195 -10.706 -4.049 1.00 11.23 H new ATOM 0 HB2 PHE A 45 -3.944 -7.821 -3.474 1.00 43.42 H new ATOM 0 HB3 PHE A 45 -5.142 -9.099 -3.509 1.00 43.42 H new ATOM 0 HD1 PHE A 45 -1.862 -10.065 -2.159 1.00 42.42 H new ATOM 0 HD2 PHE A 45 -5.672 -8.407 -1.162 1.00 70.24 H new ATOM 0 HE1 PHE A 45 -1.439 -10.505 0.218 1.00 10.24 H new ATOM 0 HE2 PHE A 45 -5.245 -8.860 1.207 1.00 31.43 H new ATOM 0 HZ PHE A 45 -3.129 -9.907 1.903 1.00 64.23 H new ATOM 723 N ASP A 46 -4.480 -10.657 -6.256 1.00 71.10 N ATOM 724 CA ASP A 46 -4.949 -10.716 -7.651 1.00 60.54 C ATOM 725 C ASP A 46 -6.263 -9.912 -7.720 1.00 50.00 C ATOM 726 O ASP A 46 -7.130 -10.141 -6.874 1.00 25.32 O ATOM 727 CB ASP A 46 -5.163 -12.188 -8.084 1.00 50.25 C ATOM 728 CG ASP A 46 -5.481 -12.368 -9.586 1.00 75.01 C ATOM 729 OD1 ASP A 46 -6.621 -12.087 -10.012 1.00 43.33 O ATOM 730 OD2 ASP A 46 -4.593 -12.805 -10.351 1.00 64.43 O ATOM 0 H ASP A 46 -4.662 -11.502 -5.714 1.00 71.10 H new ATOM 0 HA ASP A 46 -4.213 -10.290 -8.333 1.00 60.54 H new ATOM 0 HB2 ASP A 46 -4.267 -12.760 -7.843 1.00 50.25 H new ATOM 0 HB3 ASP A 46 -5.979 -12.612 -7.498 1.00 50.25 H new ATOM 735 N PRO A 47 -6.401 -8.950 -8.694 1.00 23.21 N ATOM 736 CA PRO A 47 -7.541 -7.994 -8.758 1.00 51.12 C ATOM 737 C PRO A 47 -8.941 -8.602 -8.471 1.00 63.01 C ATOM 738 O PRO A 47 -9.533 -9.284 -9.314 1.00 20.33 O ATOM 739 CB PRO A 47 -7.450 -7.487 -10.219 1.00 62.25 C ATOM 740 CG PRO A 47 -5.983 -7.477 -10.512 1.00 14.30 C ATOM 741 CD PRO A 47 -5.421 -8.691 -9.795 1.00 42.42 C ATOM 0 HA PRO A 47 -7.458 -7.230 -7.985 1.00 51.12 H new ATOM 0 HB2 PRO A 47 -7.988 -8.143 -10.903 1.00 62.25 H new ATOM 0 HB3 PRO A 47 -7.884 -6.493 -10.323 1.00 62.25 H new ATOM 0 HG2 PRO A 47 -5.796 -7.533 -11.584 1.00 14.30 H new ATOM 0 HG3 PRO A 47 -5.517 -6.559 -10.154 1.00 14.30 H new ATOM 0 HD2 PRO A 47 -5.338 -9.547 -10.465 1.00 42.42 H new ATOM 0 HD3 PRO A 47 -4.423 -8.496 -9.403 1.00 42.42 H new ATOM 749 N ASP A 48 -9.432 -8.358 -7.247 1.00 61.43 N ATOM 750 CA ASP A 48 -10.837 -8.568 -6.852 1.00 63.33 C ATOM 751 C ASP A 48 -11.524 -7.188 -6.783 1.00 31.43 C ATOM 752 O ASP A 48 -11.521 -6.542 -5.725 1.00 42.11 O ATOM 753 CB ASP A 48 -10.931 -9.310 -5.479 1.00 44.23 C ATOM 754 CG ASP A 48 -10.677 -10.824 -5.584 1.00 44.32 C ATOM 755 OD1 ASP A 48 -9.521 -11.258 -5.469 1.00 63.21 O ATOM 756 OD2 ASP A 48 -11.647 -11.587 -5.769 1.00 60.43 O ATOM 0 H ASP A 48 -8.853 -8.002 -6.487 1.00 61.43 H new ATOM 0 HA ASP A 48 -11.339 -9.198 -7.586 1.00 63.33 H new ATOM 0 HB2 ASP A 48 -10.208 -8.875 -4.789 1.00 44.23 H new ATOM 0 HB3 ASP A 48 -11.920 -9.144 -5.051 1.00 44.23 H new ATOM 761 N PRO A 49 -12.108 -6.693 -7.917 1.00 13.32 N ATOM 762 CA PRO A 49 -12.587 -5.288 -8.031 1.00 60.30 C ATOM 763 C PRO A 49 -13.804 -4.973 -7.128 1.00 21.04 C ATOM 764 O PRO A 49 -14.102 -3.805 -6.868 1.00 55.52 O ATOM 765 CB PRO A 49 -12.931 -5.167 -9.537 1.00 52.52 C ATOM 766 CG PRO A 49 -13.300 -6.561 -9.947 1.00 55.23 C ATOM 767 CD PRO A 49 -12.376 -7.466 -9.167 1.00 3.22 C ATOM 0 HA PRO A 49 -11.841 -4.569 -7.692 1.00 60.30 H new ATOM 0 HB2 PRO A 49 -13.755 -4.473 -9.702 1.00 52.52 H new ATOM 0 HB3 PRO A 49 -12.082 -4.796 -10.110 1.00 52.52 H new ATOM 0 HG2 PRO A 49 -14.344 -6.774 -9.718 1.00 55.23 H new ATOM 0 HG3 PRO A 49 -13.174 -6.701 -11.021 1.00 55.23 H new ATOM 0 HD2 PRO A 49 -12.842 -8.428 -8.953 1.00 3.22 H new ATOM 0 HD3 PRO A 49 -11.458 -7.672 -9.716 1.00 3.22 H new ATOM 775 N ASP A 50 -14.484 -6.025 -6.641 1.00 43.45 N ATOM 776 CA ASP A 50 -15.634 -5.900 -5.718 1.00 12.12 C ATOM 777 C ASP A 50 -15.195 -5.426 -4.318 1.00 65.01 C ATOM 778 O ASP A 50 -15.974 -4.797 -3.596 1.00 12.34 O ATOM 779 CB ASP A 50 -16.371 -7.264 -5.603 1.00 63.21 C ATOM 780 CG ASP A 50 -15.546 -8.359 -4.885 1.00 23.35 C ATOM 781 OD1 ASP A 50 -14.483 -8.747 -5.408 1.00 53.21 O ATOM 782 OD2 ASP A 50 -15.954 -8.824 -3.796 1.00 65.41 O ATOM 0 H ASP A 50 -14.254 -6.991 -6.875 1.00 43.45 H new ATOM 0 HA ASP A 50 -16.309 -5.149 -6.129 1.00 12.12 H new ATOM 0 HB2 ASP A 50 -17.308 -7.116 -5.066 1.00 63.21 H new ATOM 0 HB3 ASP A 50 -16.629 -7.613 -6.603 1.00 63.21 H new ATOM 787 N TYR A 51 -13.936 -5.721 -3.954 1.00 1.35 N ATOM 788 CA TYR A 51 -13.396 -5.430 -2.604 1.00 32.00 C ATOM 789 C TYR A 51 -12.784 -4.012 -2.568 1.00 55.35 C ATOM 790 O TYR A 51 -12.325 -3.541 -1.520 1.00 54.35 O ATOM 791 CB TYR A 51 -12.335 -6.511 -2.204 1.00 73.33 C ATOM 792 CG TYR A 51 -12.477 -7.014 -0.753 1.00 3.43 C ATOM 793 CD1 TYR A 51 -12.167 -6.198 0.341 1.00 61.43 C ATOM 794 CD2 TYR A 51 -12.945 -8.302 -0.483 1.00 2.23 C ATOM 795 CE1 TYR A 51 -12.316 -6.653 1.640 1.00 22.52 C ATOM 796 CE2 TYR A 51 -13.096 -8.755 0.810 1.00 35.21 C ATOM 797 CZ TYR A 51 -12.782 -7.933 1.865 1.00 63.42 C ATOM 798 OH TYR A 51 -12.930 -8.402 3.150 1.00 63.30 O ATOM 0 H TYR A 51 -13.263 -6.165 -4.579 1.00 1.35 H new ATOM 0 HA TYR A 51 -14.209 -5.466 -1.879 1.00 32.00 H new ATOM 0 HB2 TYR A 51 -12.420 -7.359 -2.883 1.00 73.33 H new ATOM 0 HB3 TYR A 51 -11.337 -6.094 -2.338 1.00 73.33 H new ATOM 0 HD1 TYR A 51 -11.805 -5.195 0.169 1.00 61.43 H new ATOM 0 HD2 TYR A 51 -13.194 -8.957 -1.305 1.00 2.23 H new ATOM 0 HE1 TYR A 51 -12.069 -6.011 2.472 1.00 22.52 H new ATOM 0 HE2 TYR A 51 -13.461 -9.755 0.994 1.00 35.21 H new ATOM 0 HH TYR A 51 -13.478 -9.214 3.141 1.00 63.30 H new ATOM 808 N ARG A 52 -12.772 -3.366 -3.738 1.00 1.22 N ATOM 809 CA ARG A 52 -12.236 -2.024 -3.935 1.00 31.53 C ATOM 810 C ARG A 52 -13.238 -0.972 -3.418 1.00 64.21 C ATOM 811 O ARG A 52 -14.429 -1.024 -3.758 1.00 52.42 O ATOM 812 CB ARG A 52 -11.970 -1.835 -5.448 1.00 51.20 C ATOM 813 CG ARG A 52 -11.212 -0.559 -5.823 1.00 4.54 C ATOM 814 CD ARG A 52 -11.082 -0.380 -7.349 1.00 25.34 C ATOM 815 NE ARG A 52 -12.354 -0.009 -7.976 1.00 10.00 N ATOM 816 CZ ARG A 52 -12.497 0.398 -9.240 1.00 70.13 C ATOM 817 NH1 ARG A 52 -11.450 0.478 -10.050 1.00 32.54 N ATOM 818 NH2 ARG A 52 -13.699 0.741 -9.683 1.00 33.21 N ATOM 0 H ARG A 52 -13.146 -3.776 -4.594 1.00 1.22 H new ATOM 0 HA ARG A 52 -11.308 -1.897 -3.378 1.00 31.53 H new ATOM 0 HB2 ARG A 52 -11.405 -2.694 -5.811 1.00 51.20 H new ATOM 0 HB3 ARG A 52 -12.926 -1.838 -5.972 1.00 51.20 H new ATOM 0 HG2 ARG A 52 -11.727 0.304 -5.401 1.00 4.54 H new ATOM 0 HG3 ARG A 52 -10.218 -0.586 -5.377 1.00 4.54 H new ATOM 0 HD2 ARG A 52 -10.338 0.388 -7.560 1.00 25.34 H new ATOM 0 HD3 ARG A 52 -10.718 -1.307 -7.792 1.00 25.34 H new ATOM 0 HE ARG A 52 -13.195 -0.066 -7.402 1.00 10.00 H new ATOM 0 HH11 ARG A 52 -10.522 0.227 -9.710 1.00 32.54 H new ATOM 0 HH12 ARG A 52 -11.573 0.790 -11.013 1.00 32.54 H new ATOM 0 HH21 ARG A 52 -14.505 0.693 -9.060 1.00 33.21 H new ATOM 0 HH22 ARG A 52 -13.817 1.053 -10.647 1.00 33.21 H new ATOM 832 N VAL A 53 -12.759 -0.022 -2.598 1.00 24.01 N ATOM 833 CA VAL A 53 -13.588 1.086 -2.070 1.00 22.03 C ATOM 834 C VAL A 53 -13.017 2.439 -2.529 1.00 54.22 C ATOM 835 O VAL A 53 -11.936 2.498 -3.127 1.00 33.10 O ATOM 836 CB VAL A 53 -13.690 1.044 -0.494 1.00 11.24 C ATOM 837 CG1 VAL A 53 -14.343 -0.270 0.004 1.00 3.42 C ATOM 838 CG2 VAL A 53 -12.318 1.274 0.174 1.00 24.40 C ATOM 0 H VAL A 53 -11.790 0.004 -2.280 1.00 24.01 H new ATOM 0 HA VAL A 53 -14.595 0.964 -2.469 1.00 22.03 H new ATOM 0 HB VAL A 53 -14.341 1.866 -0.196 1.00 11.24 H new ATOM 0 HG11 VAL A 53 -14.395 -0.261 1.093 1.00 3.42 H new ATOM 0 HG12 VAL A 53 -15.349 -0.355 -0.407 1.00 3.42 H new ATOM 0 HG13 VAL A 53 -13.745 -1.120 -0.323 1.00 3.42 H new ATOM 0 HG21 VAL A 53 -12.430 1.238 1.258 1.00 24.40 H new ATOM 0 HG22 VAL A 53 -11.623 0.497 -0.145 1.00 24.40 H new ATOM 0 HG23 VAL A 53 -11.930 2.250 -0.118 1.00 24.40 H new ATOM 848 N GLU A 54 -13.759 3.521 -2.251 1.00 33.12 N ATOM 849 CA GLU A 54 -13.321 4.910 -2.519 1.00 21.24 C ATOM 850 C GLU A 54 -13.285 5.693 -1.196 1.00 10.41 C ATOM 851 O GLU A 54 -14.006 5.347 -0.256 1.00 21.52 O ATOM 852 CB GLU A 54 -14.256 5.595 -3.553 1.00 1.25 C ATOM 853 CG GLU A 54 -15.744 5.693 -3.148 1.00 52.13 C ATOM 854 CD GLU A 54 -16.608 6.452 -4.180 1.00 2.31 C ATOM 855 OE1 GLU A 54 -17.144 5.821 -5.116 1.00 33.20 O ATOM 856 OE2 GLU A 54 -16.753 7.685 -4.059 1.00 21.44 O ATOM 0 H GLU A 54 -14.687 3.463 -1.831 1.00 33.12 H new ATOM 0 HA GLU A 54 -12.320 4.896 -2.949 1.00 21.24 H new ATOM 0 HB2 GLU A 54 -13.883 6.601 -3.742 1.00 1.25 H new ATOM 0 HB3 GLU A 54 -14.190 5.048 -4.494 1.00 1.25 H new ATOM 0 HG2 GLU A 54 -16.145 4.688 -3.017 1.00 52.13 H new ATOM 0 HG3 GLU A 54 -15.819 6.194 -2.183 1.00 52.13 H new ATOM 863 N ALA A 55 -12.441 6.740 -1.120 1.00 73.11 N ATOM 864 CA ALA A 55 -12.229 7.510 0.122 1.00 23.33 C ATOM 865 C ALA A 55 -12.044 9.003 -0.166 1.00 71.14 C ATOM 866 O ALA A 55 -11.607 9.389 -1.256 1.00 2.43 O ATOM 867 CB ALA A 55 -11.005 6.979 0.881 1.00 15.50 C ATOM 0 H ALA A 55 -11.891 7.074 -1.911 1.00 73.11 H new ATOM 0 HA ALA A 55 -13.120 7.387 0.737 1.00 23.33 H new ATOM 0 HB1 ALA A 55 -10.863 7.558 1.794 1.00 15.50 H new ATOM 0 HB2 ALA A 55 -11.162 5.931 1.137 1.00 15.50 H new ATOM 0 HB3 ALA A 55 -10.119 7.070 0.252 1.00 15.50 H new ATOM 873 N THR A 56 -12.387 9.829 0.834 1.00 2.13 N ATOM 874 CA THR A 56 -12.095 11.265 0.833 1.00 41.52 C ATOM 875 C THR A 56 -10.748 11.506 1.540 1.00 33.34 C ATOM 876 O THR A 56 -10.479 10.918 2.594 1.00 22.04 O ATOM 877 CB THR A 56 -13.222 12.063 1.562 1.00 52.22 C ATOM 878 OG1 THR A 56 -14.498 11.712 1.001 1.00 11.54 O ATOM 879 CG2 THR A 56 -13.024 13.590 1.451 1.00 23.33 C ATOM 0 H THR A 56 -12.878 9.514 1.671 1.00 2.13 H new ATOM 0 HA THR A 56 -12.043 11.613 -0.199 1.00 41.52 H new ATOM 0 HB THR A 56 -13.179 11.797 2.618 1.00 52.22 H new ATOM 0 HG1 THR A 56 -15.206 12.211 1.460 1.00 11.54 H new ATOM 0 HG21 THR A 56 -13.833 14.101 1.974 1.00 23.33 H new ATOM 0 HG22 THR A 56 -12.070 13.867 1.900 1.00 23.33 H new ATOM 0 HG23 THR A 56 -13.029 13.882 0.401 1.00 23.33 H new ATOM 887 N VAL A 57 -9.906 12.352 0.944 1.00 21.50 N ATOM 888 CA VAL A 57 -8.590 12.692 1.486 1.00 34.32 C ATOM 889 C VAL A 57 -8.713 13.812 2.535 1.00 51.44 C ATOM 890 O VAL A 57 -9.362 14.837 2.296 1.00 54.44 O ATOM 891 CB VAL A 57 -7.616 13.132 0.336 1.00 5.33 C ATOM 892 CG1 VAL A 57 -6.195 13.406 0.869 1.00 2.11 C ATOM 893 CG2 VAL A 57 -7.595 12.079 -0.793 1.00 10.42 C ATOM 0 H VAL A 57 -10.120 12.824 0.065 1.00 21.50 H new ATOM 0 HA VAL A 57 -8.179 11.805 1.968 1.00 34.32 H new ATOM 0 HB VAL A 57 -7.991 14.068 -0.078 1.00 5.33 H new ATOM 0 HG11 VAL A 57 -5.549 13.708 0.045 1.00 2.11 H new ATOM 0 HG12 VAL A 57 -6.232 14.203 1.612 1.00 2.11 H new ATOM 0 HG13 VAL A 57 -5.798 12.501 1.328 1.00 2.11 H new ATOM 0 HG21 VAL A 57 -6.914 12.403 -1.580 1.00 10.42 H new ATOM 0 HG22 VAL A 57 -7.258 11.123 -0.393 1.00 10.42 H new ATOM 0 HG23 VAL A 57 -8.598 11.967 -1.205 1.00 10.42 H new ATOM 903 N THR A 58 -8.079 13.595 3.684 1.00 1.00 N ATOM 904 CA THR A 58 -8.024 14.540 4.793 1.00 13.42 C ATOM 905 C THR A 58 -6.543 14.812 5.087 1.00 43.54 C ATOM 906 O THR A 58 -5.868 14.015 5.760 1.00 74.23 O ATOM 907 CB THR A 58 -8.754 13.959 6.052 1.00 13.03 C ATOM 908 OG1 THR A 58 -10.120 13.642 5.726 1.00 32.02 O ATOM 909 CG2 THR A 58 -8.723 14.930 7.242 1.00 2.40 C ATOM 0 H THR A 58 -7.574 12.729 3.874 1.00 1.00 H new ATOM 0 HA THR A 58 -8.533 15.468 4.534 1.00 13.42 H new ATOM 0 HB THR A 58 -8.220 13.056 6.347 1.00 13.03 H new ATOM 0 HG1 THR A 58 -10.569 13.278 6.517 1.00 32.02 H new ATOM 0 HG21 THR A 58 -9.241 14.483 8.090 1.00 2.40 H new ATOM 0 HG22 THR A 58 -7.688 15.136 7.517 1.00 2.40 H new ATOM 0 HG23 THR A 58 -9.217 15.861 6.965 1.00 2.40 H new ATOM 917 N VAL A 59 -6.024 15.921 4.550 1.00 41.22 N ATOM 918 CA VAL A 59 -4.591 16.229 4.601 1.00 53.02 C ATOM 919 C VAL A 59 -4.262 16.970 5.893 1.00 51.24 C ATOM 920 O VAL A 59 -4.937 17.937 6.258 1.00 75.21 O ATOM 921 CB VAL A 59 -4.109 17.032 3.325 1.00 12.51 C ATOM 922 CG1 VAL A 59 -2.820 17.862 3.568 1.00 33.42 C ATOM 923 CG2 VAL A 59 -3.893 16.052 2.151 1.00 35.12 C ATOM 0 H VAL A 59 -6.582 16.627 4.070 1.00 41.22 H new ATOM 0 HA VAL A 59 -4.042 15.288 4.594 1.00 53.02 H new ATOM 0 HB VAL A 59 -4.895 17.749 3.086 1.00 12.51 H new ATOM 0 HG11 VAL A 59 -2.547 18.386 2.652 1.00 33.42 H new ATOM 0 HG12 VAL A 59 -2.998 18.587 4.362 1.00 33.42 H new ATOM 0 HG13 VAL A 59 -2.008 17.196 3.861 1.00 33.42 H new ATOM 0 HG21 VAL A 59 -3.561 16.605 1.272 1.00 35.12 H new ATOM 0 HG22 VAL A 59 -3.136 15.317 2.425 1.00 35.12 H new ATOM 0 HG23 VAL A 59 -4.829 15.541 1.926 1.00 35.12 H new ATOM 933 N HIS A 60 -3.227 16.477 6.574 1.00 43.42 N ATOM 934 CA HIS A 60 -2.711 17.060 7.803 1.00 72.42 C ATOM 935 C HIS A 60 -1.759 18.214 7.460 1.00 55.22 C ATOM 936 O HIS A 60 -0.684 18.000 6.885 1.00 13.00 O ATOM 937 CB HIS A 60 -2.015 15.951 8.634 1.00 71.32 C ATOM 938 CG HIS A 60 -2.999 14.983 9.232 1.00 25.42 C ATOM 939 ND1 HIS A 60 -3.955 14.314 8.486 1.00 62.54 N ATOM 940 CD2 HIS A 60 -3.227 14.620 10.519 1.00 12.04 C ATOM 941 CE1 HIS A 60 -4.721 13.608 9.289 1.00 32.34 C ATOM 942 NE2 HIS A 60 -4.298 13.771 10.521 1.00 35.24 N ATOM 0 H HIS A 60 -2.717 15.645 6.277 1.00 43.42 H new ATOM 0 HA HIS A 60 -3.520 17.472 8.406 1.00 72.42 H new ATOM 0 HB2 HIS A 60 -1.316 15.408 7.998 1.00 71.32 H new ATOM 0 HB3 HIS A 60 -1.430 16.410 9.431 1.00 71.32 H new ATOM 0 HD2 HIS A 60 -2.665 14.943 11.383 1.00 12.04 H new ATOM 0 HE1 HIS A 60 -5.558 12.997 8.986 1.00 32.34 H new ATOM 0 HE2 HIS A 60 -4.704 13.334 11.348 1.00 35.24 H new ATOM 951 N GLU A 61 -2.197 19.437 7.811 1.00 42.53 N ATOM 952 CA GLU A 61 -1.460 20.696 7.564 1.00 11.55 C ATOM 953 C GLU A 61 -0.073 20.698 8.240 1.00 42.41 C ATOM 954 O GLU A 61 0.825 21.436 7.831 1.00 41.20 O ATOM 955 CB GLU A 61 -2.320 21.881 8.070 1.00 64.12 C ATOM 956 CG GLU A 61 -2.625 21.829 9.584 1.00 74.40 C ATOM 957 CD GLU A 61 -3.658 22.869 10.032 1.00 33.14 C ATOM 958 OE1 GLU A 61 -4.867 22.565 10.007 1.00 3.25 O ATOM 959 OE2 GLU A 61 -3.268 23.997 10.400 1.00 55.24 O ATOM 0 H GLU A 61 -3.089 19.584 8.283 1.00 42.53 H new ATOM 0 HA GLU A 61 -1.283 20.793 6.493 1.00 11.55 H new ATOM 0 HB2 GLU A 61 -1.804 22.814 7.845 1.00 64.12 H new ATOM 0 HB3 GLU A 61 -3.261 21.896 7.520 1.00 64.12 H new ATOM 0 HG2 GLU A 61 -2.988 20.834 9.840 1.00 74.40 H new ATOM 0 HG3 GLU A 61 -1.700 21.984 10.139 1.00 74.40 H new ATOM 966 N THR A 62 0.074 19.883 9.295 1.00 61.11 N ATOM 967 CA THR A 62 1.350 19.651 9.977 1.00 71.40 C ATOM 968 C THR A 62 1.718 18.148 9.852 1.00 0.31 C ATOM 969 O THR A 62 1.195 17.323 10.611 1.00 35.52 O ATOM 970 CB THR A 62 1.256 20.104 11.479 1.00 70.12 C ATOM 971 OG1 THR A 62 0.127 19.481 12.119 1.00 12.45 O ATOM 972 CG2 THR A 62 1.120 21.632 11.619 1.00 31.00 C ATOM 0 H THR A 62 -0.702 19.361 9.702 1.00 61.11 H new ATOM 0 HA THR A 62 2.138 20.243 9.512 1.00 71.40 H new ATOM 0 HB THR A 62 2.184 19.795 11.959 1.00 70.12 H new ATOM 0 HG1 THR A 62 0.065 18.545 11.835 1.00 12.45 H new ATOM 0 HG21 THR A 62 1.059 21.897 12.675 1.00 31.00 H new ATOM 0 HG22 THR A 62 1.989 22.117 11.173 1.00 31.00 H new ATOM 0 HG23 THR A 62 0.217 21.965 11.108 1.00 31.00 H new ATOM 980 N PRO A 63 2.567 17.755 8.841 1.00 44.54 N ATOM 981 CA PRO A 63 2.944 16.335 8.624 1.00 71.25 C ATOM 982 C PRO A 63 3.820 15.788 9.773 1.00 64.02 C ATOM 983 O PRO A 63 4.886 16.341 10.082 1.00 44.13 O ATOM 984 CB PRO A 63 3.707 16.371 7.272 1.00 31.14 C ATOM 985 CG PRO A 63 4.242 17.767 7.171 1.00 72.32 C ATOM 986 CD PRO A 63 3.199 18.647 7.827 1.00 62.23 C ATOM 0 HA PRO A 63 2.084 15.666 8.603 1.00 71.25 H new ATOM 0 HB2 PRO A 63 4.512 15.637 7.253 1.00 31.14 H new ATOM 0 HB3 PRO A 63 3.045 16.140 6.438 1.00 31.14 H new ATOM 0 HG2 PRO A 63 5.204 17.856 7.675 1.00 72.32 H new ATOM 0 HG3 PRO A 63 4.399 18.053 6.131 1.00 72.32 H new ATOM 0 HD2 PRO A 63 3.650 19.524 8.291 1.00 62.23 H new ATOM 0 HD3 PRO A 63 2.469 19.010 7.103 1.00 62.23 H new ATOM 994 N GLU A 64 3.362 14.699 10.404 1.00 42.23 N ATOM 995 CA GLU A 64 4.034 14.097 11.572 1.00 13.03 C ATOM 996 C GLU A 64 4.994 12.973 11.139 1.00 60.41 C ATOM 997 O GLU A 64 4.830 12.378 10.068 1.00 4.53 O ATOM 998 CB GLU A 64 2.966 13.595 12.588 1.00 62.43 C ATOM 999 CG GLU A 64 1.964 12.573 12.023 1.00 60.44 C ATOM 1000 CD GLU A 64 0.752 12.318 12.932 1.00 2.34 C ATOM 1001 OE1 GLU A 64 -0.251 13.063 12.829 1.00 61.11 O ATOM 1002 OE2 GLU A 64 0.793 11.382 13.753 1.00 1.35 O ATOM 0 H GLU A 64 2.514 14.207 10.122 1.00 42.23 H new ATOM 0 HA GLU A 64 4.643 14.854 12.066 1.00 13.03 H new ATOM 0 HB2 GLU A 64 3.478 13.147 13.440 1.00 62.43 H new ATOM 0 HB3 GLU A 64 2.412 14.455 12.965 1.00 62.43 H new ATOM 0 HG2 GLU A 64 1.611 12.924 11.053 1.00 60.44 H new ATOM 0 HG3 GLU A 64 2.481 11.629 11.851 1.00 60.44 H new ATOM 1009 N SER A 65 5.998 12.704 11.986 1.00 75.23 N ATOM 1010 CA SER A 65 7.085 11.758 11.693 1.00 3.51 C ATOM 1011 C SER A 65 6.659 10.318 12.025 1.00 40.41 C ATOM 1012 O SER A 65 6.300 10.023 13.169 1.00 32.24 O ATOM 1013 CB SER A 65 8.326 12.158 12.519 1.00 23.43 C ATOM 1014 OG SER A 65 8.752 13.472 12.208 1.00 32.33 O ATOM 0 H SER A 65 6.079 13.142 12.904 1.00 75.23 H new ATOM 0 HA SER A 65 7.322 11.796 10.630 1.00 3.51 H new ATOM 0 HB2 SER A 65 8.094 12.091 13.582 1.00 23.43 H new ATOM 0 HB3 SER A 65 9.136 11.456 12.324 1.00 23.43 H new ATOM 0 HG SER A 65 9.538 13.697 12.748 1.00 32.33 H new ATOM 1020 N VAL A 66 6.684 9.424 11.018 1.00 72.23 N ATOM 1021 CA VAL A 66 6.290 8.006 11.174 1.00 4.22 C ATOM 1022 C VAL A 66 7.416 7.091 10.643 1.00 50.31 C ATOM 1023 O VAL A 66 7.823 7.227 9.489 1.00 65.21 O ATOM 1024 CB VAL A 66 4.944 7.710 10.396 1.00 41.14 C ATOM 1025 CG1 VAL A 66 4.424 6.279 10.671 1.00 0.14 C ATOM 1026 CG2 VAL A 66 3.863 8.774 10.717 1.00 3.11 C ATOM 0 H VAL A 66 6.978 9.663 10.071 1.00 72.23 H new ATOM 0 HA VAL A 66 6.127 7.805 12.233 1.00 4.22 H new ATOM 0 HB VAL A 66 5.166 7.773 9.331 1.00 41.14 H new ATOM 0 HG11 VAL A 66 3.499 6.116 10.119 1.00 0.14 H new ATOM 0 HG12 VAL A 66 5.171 5.553 10.351 1.00 0.14 H new ATOM 0 HG13 VAL A 66 4.236 6.159 11.738 1.00 0.14 H new ATOM 0 HG21 VAL A 66 2.951 8.543 10.167 1.00 3.11 H new ATOM 0 HG22 VAL A 66 3.654 8.769 11.787 1.00 3.11 H new ATOM 0 HG23 VAL A 66 4.224 9.760 10.423 1.00 3.11 H new ATOM 1036 N ASP A 67 7.913 6.167 11.491 1.00 72.02 N ATOM 1037 CA ASP A 67 8.959 5.197 11.098 1.00 30.32 C ATOM 1038 C ASP A 67 8.321 4.044 10.313 1.00 3.24 C ATOM 1039 O ASP A 67 7.583 3.247 10.880 1.00 60.51 O ATOM 1040 CB ASP A 67 9.709 4.623 12.343 1.00 22.03 C ATOM 1041 CG ASP A 67 10.769 5.569 12.935 1.00 31.44 C ATOM 1042 OD1 ASP A 67 11.926 5.533 12.486 1.00 70.11 O ATOM 1043 OD2 ASP A 67 10.460 6.328 13.871 1.00 21.11 O ATOM 0 H ASP A 67 7.605 6.071 12.459 1.00 72.02 H new ATOM 0 HA ASP A 67 9.685 5.721 10.476 1.00 30.32 H new ATOM 0 HB2 ASP A 67 8.978 4.386 13.116 1.00 22.03 H new ATOM 0 HB3 ASP A 67 10.191 3.686 12.062 1.00 22.03 H new ATOM 1048 N LEU A 68 8.594 3.975 9.006 1.00 41.23 N ATOM 1049 CA LEU A 68 8.170 2.850 8.149 1.00 11.31 C ATOM 1050 C LEU A 68 9.407 2.259 7.472 1.00 13.24 C ATOM 1051 O LEU A 68 10.491 2.861 7.513 1.00 54.05 O ATOM 1052 CB LEU A 68 7.145 3.307 7.075 1.00 74.24 C ATOM 1053 CG LEU A 68 5.864 4.037 7.584 1.00 22.52 C ATOM 1054 CD1 LEU A 68 4.999 4.505 6.406 1.00 64.33 C ATOM 1055 CD2 LEU A 68 5.040 3.162 8.554 1.00 50.51 C ATOM 0 H LEU A 68 9.115 4.696 8.507 1.00 41.23 H new ATOM 0 HA LEU A 68 7.681 2.099 8.770 1.00 11.31 H new ATOM 0 HB2 LEU A 68 7.658 3.969 6.378 1.00 74.24 H new ATOM 0 HB3 LEU A 68 6.833 2.429 6.510 1.00 74.24 H new ATOM 0 HG LEU A 68 6.195 4.912 8.143 1.00 22.52 H new ATOM 0 HD11 LEU A 68 4.111 5.011 6.785 1.00 64.33 H new ATOM 0 HD12 LEU A 68 5.572 5.193 5.785 1.00 64.33 H new ATOM 0 HD13 LEU A 68 4.699 3.643 5.810 1.00 64.33 H new ATOM 0 HD21 LEU A 68 4.158 3.713 8.881 1.00 50.51 H new ATOM 0 HD22 LEU A 68 4.730 2.249 8.046 1.00 50.51 H new ATOM 0 HD23 LEU A 68 5.650 2.906 9.420 1.00 50.51 H new ATOM 1067 N GLU A 69 9.251 1.084 6.847 1.00 15.51 N ATOM 1068 CA GLU A 69 10.327 0.479 6.057 1.00 74.02 C ATOM 1069 C GLU A 69 10.259 0.976 4.611 1.00 63.43 C ATOM 1070 O GLU A 69 9.201 1.420 4.125 1.00 34.21 O ATOM 1071 CB GLU A 69 10.285 -1.071 6.099 1.00 32.34 C ATOM 1072 CG GLU A 69 9.133 -1.755 5.327 1.00 24.32 C ATOM 1073 CD GLU A 69 9.307 -3.285 5.245 1.00 31.23 C ATOM 1074 OE1 GLU A 69 10.388 -3.723 4.811 1.00 52.22 O ATOM 1075 OE2 GLU A 69 8.378 -4.044 5.600 1.00 23.53 O ATOM 0 H GLU A 69 8.391 0.536 6.874 1.00 15.51 H new ATOM 0 HA GLU A 69 11.273 0.786 6.502 1.00 74.02 H new ATOM 0 HB2 GLU A 69 11.229 -1.448 5.706 1.00 32.34 H new ATOM 0 HB3 GLU A 69 10.227 -1.382 7.142 1.00 32.34 H new ATOM 0 HG2 GLU A 69 8.186 -1.525 5.815 1.00 24.32 H new ATOM 0 HG3 GLU A 69 9.080 -1.344 4.319 1.00 24.32 H new ATOM 1082 N THR A 70 11.412 0.938 3.950 1.00 23.32 N ATOM 1083 CA THR A 70 11.537 1.193 2.515 1.00 50.05 C ATOM 1084 C THR A 70 12.016 -0.100 1.816 1.00 74.20 C ATOM 1085 O THR A 70 12.201 -1.138 2.473 1.00 25.35 O ATOM 1086 CB THR A 70 12.515 2.396 2.270 1.00 51.13 C ATOM 1087 OG1 THR A 70 12.552 2.756 0.879 1.00 44.53 O ATOM 1088 CG2 THR A 70 13.944 2.102 2.776 1.00 3.21 C ATOM 0 H THR A 70 12.301 0.726 4.402 1.00 23.32 H new ATOM 0 HA THR A 70 10.572 1.471 2.091 1.00 50.05 H new ATOM 0 HB THR A 70 12.125 3.236 2.845 1.00 51.13 H new ATOM 0 HG1 THR A 70 13.167 3.509 0.752 1.00 44.53 H new ATOM 0 HG21 THR A 70 14.583 2.964 2.584 1.00 3.21 H new ATOM 0 HG22 THR A 70 13.917 1.902 3.847 1.00 3.21 H new ATOM 0 HG23 THR A 70 14.343 1.232 2.255 1.00 3.21 H new ATOM 1096 N SER A 71 12.252 -0.024 0.501 1.00 53.05 N ATOM 1097 CA SER A 71 12.660 -1.177 -0.332 1.00 32.45 C ATOM 1098 C SER A 71 14.169 -1.510 -0.185 1.00 23.23 C ATOM 1099 O SER A 71 14.720 -2.266 -0.981 1.00 3.11 O ATOM 1100 CB SER A 71 12.320 -0.849 -1.795 1.00 22.12 C ATOM 1101 OG SER A 71 10.960 -0.457 -1.938 1.00 13.41 O ATOM 0 H SER A 71 12.166 0.845 -0.026 1.00 53.05 H new ATOM 0 HA SER A 71 12.119 -2.062 0.003 1.00 32.45 H new ATOM 0 HB2 SER A 71 12.970 -0.049 -2.150 1.00 22.12 H new ATOM 0 HB3 SER A 71 12.516 -1.720 -2.420 1.00 22.12 H new ATOM 0 HG SER A 71 10.732 -0.408 -2.890 1.00 13.41 H new ATOM 1107 N ASP A 72 14.788 -1.030 0.905 1.00 12.43 N ATOM 1108 CA ASP A 72 16.255 -1.041 1.107 1.00 72.52 C ATOM 1109 C ASP A 72 16.565 -1.770 2.431 1.00 75.10 C ATOM 1110 O ASP A 72 17.663 -1.668 2.962 1.00 71.34 O ATOM 1111 CB ASP A 72 16.789 0.429 1.116 1.00 2.44 C ATOM 1112 CG ASP A 72 18.329 0.573 1.197 1.00 3.21 C ATOM 1113 OD1 ASP A 72 19.007 0.396 0.166 1.00 33.42 O ATOM 1114 OD2 ASP A 72 18.864 0.887 2.287 1.00 22.14 O ATOM 0 H ASP A 72 14.280 -0.616 1.686 1.00 12.43 H new ATOM 0 HA ASP A 72 16.755 -1.570 0.296 1.00 72.52 H new ATOM 0 HB2 ASP A 72 16.441 0.930 0.213 1.00 2.44 H new ATOM 0 HB3 ASP A 72 16.346 0.954 1.963 1.00 2.44 H new ATOM 1119 N ASP A 73 15.557 -2.534 2.937 1.00 43.25 N ATOM 1120 CA ASP A 73 15.553 -3.201 4.273 1.00 42.41 C ATOM 1121 C ASP A 73 15.923 -2.245 5.433 1.00 64.55 C ATOM 1122 O ASP A 73 16.231 -2.672 6.545 1.00 23.11 O ATOM 1123 CB ASP A 73 16.380 -4.536 4.281 1.00 1.44 C ATOM 1124 CG ASP A 73 17.902 -4.400 4.116 1.00 62.35 C ATOM 1125 OD1 ASP A 73 18.604 -4.150 5.117 1.00 20.10 O ATOM 1126 OD2 ASP A 73 18.408 -4.567 2.983 1.00 44.30 O ATOM 0 H ASP A 73 14.700 -2.709 2.413 1.00 43.25 H new ATOM 0 HA ASP A 73 14.519 -3.489 4.462 1.00 42.41 H new ATOM 0 HB2 ASP A 73 16.183 -5.054 5.220 1.00 1.44 H new ATOM 0 HB3 ASP A 73 16.006 -5.174 3.481 1.00 1.44 H new ATOM 1131 N ARG A 74 15.777 -0.942 5.158 1.00 21.44 N ATOM 1132 CA ARG A 74 16.152 0.151 6.061 1.00 63.25 C ATOM 1133 C ARG A 74 14.881 0.724 6.722 1.00 31.31 C ATOM 1134 O ARG A 74 13.755 0.420 6.301 1.00 61.15 O ATOM 1135 CB ARG A 74 16.900 1.235 5.214 1.00 53.11 C ATOM 1136 CG ARG A 74 17.527 2.408 6.004 1.00 32.13 C ATOM 1137 CD ARG A 74 18.175 3.466 5.095 1.00 43.51 C ATOM 1138 NE ARG A 74 18.742 4.583 5.872 1.00 4.04 N ATOM 1139 CZ ARG A 74 19.243 5.721 5.354 1.00 64.33 C ATOM 1140 NH1 ARG A 74 19.258 5.933 4.037 1.00 42.33 N ATOM 1141 NH2 ARG A 74 19.734 6.646 6.173 1.00 54.21 N ATOM 0 H ARG A 74 15.384 -0.612 4.277 1.00 21.44 H new ATOM 0 HA ARG A 74 16.810 -0.197 6.857 1.00 63.25 H new ATOM 0 HB2 ARG A 74 17.691 0.742 4.648 1.00 53.11 H new ATOM 0 HB3 ARG A 74 16.198 1.647 4.489 1.00 53.11 H new ATOM 0 HG2 ARG A 74 16.757 2.882 6.612 1.00 32.13 H new ATOM 0 HG3 ARG A 74 18.278 2.017 6.690 1.00 32.13 H new ATOM 0 HD2 ARG A 74 18.961 3.001 4.500 1.00 43.51 H new ATOM 0 HD3 ARG A 74 17.431 3.850 4.397 1.00 43.51 H new ATOM 0 HE ARG A 74 18.756 4.486 6.887 1.00 4.04 H new ATOM 0 HH11 ARG A 74 18.886 5.227 3.402 1.00 42.33 H new ATOM 0 HH12 ARG A 74 19.642 6.802 3.665 1.00 42.33 H new ATOM 0 HH21 ARG A 74 19.728 6.490 7.181 1.00 54.21 H new ATOM 0 HH22 ARG A 74 20.116 7.512 5.793 1.00 54.21 H new ATOM 1155 N THR A 75 15.076 1.592 7.717 1.00 14.41 N ATOM 1156 CA THR A 75 14.001 2.288 8.411 1.00 34.34 C ATOM 1157 C THR A 75 14.175 3.765 8.074 1.00 40.23 C ATOM 1158 O THR A 75 15.260 4.325 8.287 1.00 50.12 O ATOM 1159 CB THR A 75 14.069 2.079 9.959 1.00 63.55 C ATOM 1160 OG1 THR A 75 14.108 0.674 10.260 1.00 3.44 O ATOM 1161 CG2 THR A 75 12.872 2.727 10.682 1.00 42.12 C ATOM 0 H THR A 75 16.004 1.832 8.066 1.00 14.41 H new ATOM 0 HA THR A 75 13.032 1.902 8.094 1.00 34.34 H new ATOM 0 HB THR A 75 14.978 2.564 10.316 1.00 63.55 H new ATOM 0 HG1 THR A 75 14.152 0.549 11.231 1.00 3.44 H new ATOM 0 HG21 THR A 75 12.960 2.557 11.755 1.00 42.12 H new ATOM 0 HG22 THR A 75 12.864 3.799 10.483 1.00 42.12 H new ATOM 0 HG23 THR A 75 11.945 2.284 10.319 1.00 42.12 H new ATOM 1169 N VAL A 76 13.133 4.386 7.521 1.00 30.22 N ATOM 1170 CA VAL A 76 13.190 5.785 7.064 1.00 12.24 C ATOM 1171 C VAL A 76 11.929 6.528 7.516 1.00 33.44 C ATOM 1172 O VAL A 76 10.835 5.950 7.584 1.00 44.13 O ATOM 1173 CB VAL A 76 13.392 5.922 5.503 1.00 33.14 C ATOM 1174 CG1 VAL A 76 14.821 5.511 5.068 1.00 1.12 C ATOM 1175 CG2 VAL A 76 12.330 5.129 4.726 1.00 10.30 C ATOM 0 H VAL A 76 12.227 3.941 7.375 1.00 30.22 H new ATOM 0 HA VAL A 76 14.069 6.238 7.522 1.00 12.24 H new ATOM 0 HB VAL A 76 13.267 6.977 5.258 1.00 33.14 H new ATOM 0 HG11 VAL A 76 14.918 5.620 3.988 1.00 1.12 H new ATOM 0 HG12 VAL A 76 15.551 6.151 5.564 1.00 1.12 H new ATOM 0 HG13 VAL A 76 15.001 4.472 5.346 1.00 1.12 H new ATOM 0 HG21 VAL A 76 12.499 5.246 3.656 1.00 10.30 H new ATOM 0 HG22 VAL A 76 12.398 4.074 4.991 1.00 10.30 H new ATOM 0 HG23 VAL A 76 11.338 5.504 4.979 1.00 10.30 H new ATOM 1185 N ARG A 77 12.115 7.805 7.859 1.00 2.43 N ATOM 1186 CA ARG A 77 11.054 8.663 8.383 1.00 42.14 C ATOM 1187 C ARG A 77 10.172 9.165 7.229 1.00 30.01 C ATOM 1188 O ARG A 77 10.653 9.836 6.313 1.00 4.42 O ATOM 1189 CB ARG A 77 11.704 9.834 9.183 1.00 21.02 C ATOM 1190 CG ARG A 77 10.737 10.742 9.997 1.00 72.21 C ATOM 1191 CD ARG A 77 10.121 11.895 9.182 1.00 72.35 C ATOM 1192 NE ARG A 77 11.159 12.823 8.696 1.00 41.12 N ATOM 1193 CZ ARG A 77 11.337 13.209 7.422 1.00 15.15 C ATOM 1194 NH1 ARG A 77 10.549 12.762 6.457 1.00 12.33 N ATOM 1195 NH2 ARG A 77 12.314 14.051 7.130 1.00 23.11 N ATOM 0 H ARG A 77 13.016 8.275 7.779 1.00 2.43 H new ATOM 0 HA ARG A 77 10.408 8.106 9.061 1.00 42.14 H new ATOM 0 HB2 ARG A 77 12.436 9.411 9.872 1.00 21.02 H new ATOM 0 HB3 ARG A 77 12.253 10.463 8.482 1.00 21.02 H new ATOM 0 HG2 ARG A 77 9.933 10.127 10.402 1.00 72.21 H new ATOM 0 HG3 ARG A 77 11.277 11.160 10.847 1.00 72.21 H new ATOM 0 HD2 ARG A 77 9.568 11.489 8.335 1.00 72.35 H new ATOM 0 HD3 ARG A 77 9.405 12.438 9.800 1.00 72.35 H new ATOM 0 HE ARG A 77 11.800 13.207 9.391 1.00 41.12 H new ATOM 0 HH11 ARG A 77 9.792 12.114 6.676 1.00 12.33 H new ATOM 0 HH12 ARG A 77 10.698 13.066 5.495 1.00 12.33 H new ATOM 0 HH21 ARG A 77 12.924 14.401 7.869 1.00 23.11 H new ATOM 0 HH22 ARG A 77 12.458 14.351 6.166 1.00 23.11 H new ATOM 1209 N TYR A 78 8.884 8.832 7.299 1.00 54.13 N ATOM 1210 CA TYR A 78 7.862 9.319 6.365 1.00 21.21 C ATOM 1211 C TYR A 78 7.110 10.477 7.023 1.00 1.22 C ATOM 1212 O TYR A 78 6.946 10.515 8.250 1.00 30.14 O ATOM 1213 CB TYR A 78 6.848 8.195 6.018 1.00 30.30 C ATOM 1214 CG TYR A 78 7.345 7.100 5.056 1.00 34.24 C ATOM 1215 CD1 TYR A 78 8.446 6.306 5.364 1.00 22.15 C ATOM 1216 CD2 TYR A 78 6.684 6.841 3.850 1.00 73.25 C ATOM 1217 CE1 TYR A 78 8.868 5.304 4.509 1.00 3.04 C ATOM 1218 CE2 TYR A 78 7.102 5.835 2.998 1.00 62.32 C ATOM 1219 CZ TYR A 78 8.196 5.068 3.332 1.00 54.21 C ATOM 1220 OH TYR A 78 8.616 4.059 2.488 1.00 73.00 O ATOM 0 H TYR A 78 8.513 8.208 8.015 1.00 54.13 H new ATOM 0 HA TYR A 78 8.350 9.644 5.446 1.00 21.21 H new ATOM 0 HB2 TYR A 78 6.535 7.718 6.947 1.00 30.30 H new ATOM 0 HB3 TYR A 78 5.962 8.656 5.582 1.00 30.30 H new ATOM 0 HD1 TYR A 78 8.980 6.475 6.287 1.00 22.15 H new ATOM 0 HD2 TYR A 78 5.828 7.441 3.578 1.00 73.25 H new ATOM 0 HE1 TYR A 78 9.729 4.704 4.766 1.00 3.04 H new ATOM 0 HE2 TYR A 78 6.573 5.652 2.075 1.00 62.32 H new ATOM 0 HH TYR A 78 8.779 3.244 3.008 1.00 73.00 H new ATOM 1230 N LEU A 79 6.670 11.422 6.198 1.00 51.04 N ATOM 1231 CA LEU A 79 5.803 12.516 6.631 1.00 42.34 C ATOM 1232 C LEU A 79 4.351 12.137 6.343 1.00 11.33 C ATOM 1233 O LEU A 79 4.002 11.800 5.197 1.00 43.53 O ATOM 1234 CB LEU A 79 6.199 13.836 5.923 1.00 13.31 C ATOM 1235 CG LEU A 79 7.592 14.415 6.325 1.00 13.31 C ATOM 1236 CD1 LEU A 79 7.899 15.723 5.564 1.00 34.21 C ATOM 1237 CD2 LEU A 79 7.693 14.614 7.859 1.00 43.20 C ATOM 0 H LEU A 79 6.905 11.452 5.206 1.00 51.04 H new ATOM 0 HA LEU A 79 5.918 12.681 7.702 1.00 42.34 H new ATOM 0 HB2 LEU A 79 6.190 13.668 4.846 1.00 13.31 H new ATOM 0 HB3 LEU A 79 5.437 14.586 6.135 1.00 13.31 H new ATOM 0 HG LEU A 79 8.349 13.686 6.037 1.00 13.31 H new ATOM 0 HD11 LEU A 79 8.876 16.100 5.867 1.00 34.21 H new ATOM 0 HD12 LEU A 79 7.902 15.528 4.492 1.00 34.21 H new ATOM 0 HD13 LEU A 79 7.136 16.466 5.795 1.00 34.21 H new ATOM 0 HD21 LEU A 79 8.674 15.018 8.110 1.00 43.20 H new ATOM 0 HD22 LEU A 79 6.920 15.308 8.188 1.00 43.20 H new ATOM 0 HD23 LEU A 79 7.557 13.656 8.360 1.00 43.20 H new ATOM 1249 N HIS A 80 3.524 12.147 7.401 1.00 44.23 N ATOM 1250 CA HIS A 80 2.100 11.854 7.294 1.00 63.32 C ATOM 1251 C HIS A 80 1.391 13.082 6.715 1.00 22.44 C ATOM 1252 O HIS A 80 1.096 14.051 7.425 1.00 52.51 O ATOM 1253 CB HIS A 80 1.545 11.471 8.687 1.00 44.31 C ATOM 1254 CG HIS A 80 0.060 11.250 8.733 1.00 34.00 C ATOM 1255 ND1 HIS A 80 -0.721 11.782 9.729 1.00 35.32 N ATOM 1256 CD2 HIS A 80 -0.725 10.560 7.880 1.00 13.24 C ATOM 1257 CE1 HIS A 80 -1.950 11.407 9.453 1.00 33.34 C ATOM 1258 NE2 HIS A 80 -1.998 10.667 8.347 1.00 25.14 N ATOM 0 H HIS A 80 3.831 12.359 8.350 1.00 44.23 H new ATOM 0 HA HIS A 80 1.926 11.009 6.628 1.00 63.32 H new ATOM 0 HB2 HIS A 80 2.044 10.563 9.025 1.00 44.31 H new ATOM 0 HB3 HIS A 80 1.803 12.259 9.395 1.00 44.31 H new ATOM 0 HD2 HIS A 80 -0.405 10.026 6.997 1.00 13.24 H new ATOM 0 HE1 HIS A 80 -2.813 11.666 10.049 1.00 33.34 H new ATOM 0 HE2 HIS A 80 -2.833 10.257 7.928 1.00 25.14 H new ATOM 1266 N VAL A 81 1.132 13.019 5.411 1.00 42.22 N ATOM 1267 CA VAL A 81 0.548 14.135 4.661 1.00 61.11 C ATOM 1268 C VAL A 81 -0.976 14.030 4.599 1.00 22.42 C ATOM 1269 O VAL A 81 -1.651 15.046 4.611 1.00 54.44 O ATOM 1270 CB VAL A 81 1.155 14.231 3.214 1.00 43.12 C ATOM 1271 CG1 VAL A 81 2.670 14.540 3.282 1.00 24.01 C ATOM 1272 CG2 VAL A 81 0.875 12.946 2.394 1.00 71.21 C ATOM 0 H VAL A 81 1.320 12.194 4.842 1.00 42.22 H new ATOM 0 HA VAL A 81 0.801 15.050 5.196 1.00 61.11 H new ATOM 0 HB VAL A 81 0.664 15.054 2.695 1.00 43.12 H new ATOM 0 HG11 VAL A 81 3.074 14.603 2.272 1.00 24.01 H new ATOM 0 HG12 VAL A 81 2.825 15.489 3.795 1.00 24.01 H new ATOM 0 HG13 VAL A 81 3.179 13.746 3.828 1.00 24.01 H new ATOM 0 HG21 VAL A 81 1.309 13.047 1.399 1.00 71.21 H new ATOM 0 HG22 VAL A 81 1.320 12.088 2.898 1.00 71.21 H new ATOM 0 HG23 VAL A 81 -0.201 12.797 2.307 1.00 71.21 H new ATOM 1282 N ALA A 82 -1.516 12.798 4.569 1.00 51.30 N ATOM 1283 CA ALA A 82 -2.960 12.579 4.324 1.00 73.53 C ATOM 1284 C ALA A 82 -3.515 11.414 5.146 1.00 14.42 C ATOM 1285 O ALA A 82 -2.768 10.567 5.611 1.00 15.40 O ATOM 1286 CB ALA A 82 -3.204 12.330 2.824 1.00 3.42 C ATOM 0 H ALA A 82 -0.981 11.941 4.710 1.00 51.30 H new ATOM 0 HA ALA A 82 -3.487 13.479 4.639 1.00 73.53 H new ATOM 0 HB1 ALA A 82 -4.268 12.170 2.650 1.00 3.42 H new ATOM 0 HB2 ALA A 82 -2.869 13.196 2.252 1.00 3.42 H new ATOM 0 HB3 ALA A 82 -2.648 11.448 2.506 1.00 3.42 H new ATOM 1292 N THR A 83 -4.842 11.401 5.314 1.00 23.55 N ATOM 1293 CA THR A 83 -5.590 10.282 5.902 1.00 15.51 C ATOM 1294 C THR A 83 -6.845 10.064 5.059 1.00 51.13 C ATOM 1295 O THR A 83 -7.561 11.013 4.740 1.00 72.13 O ATOM 1296 CB THR A 83 -5.992 10.546 7.388 1.00 1.03 C ATOM 1297 OG1 THR A 83 -4.816 10.800 8.162 1.00 32.42 O ATOM 1298 CG2 THR A 83 -6.760 9.358 8.003 1.00 43.15 C ATOM 0 H THR A 83 -5.438 12.182 5.040 1.00 23.55 H new ATOM 0 HA THR A 83 -4.951 9.399 5.903 1.00 15.51 H new ATOM 0 HB THR A 83 -6.653 11.412 7.401 1.00 1.03 H new ATOM 0 HG1 THR A 83 -4.599 10.008 8.697 1.00 32.42 H new ATOM 0 HG21 THR A 83 -7.018 9.588 9.037 1.00 43.15 H new ATOM 0 HG22 THR A 83 -7.671 9.179 7.432 1.00 43.15 H new ATOM 0 HG23 THR A 83 -6.134 8.466 7.975 1.00 43.15 H new ATOM 1306 N LEU A 84 -7.097 8.816 4.698 1.00 11.23 N ATOM 1307 CA LEU A 84 -8.140 8.454 3.747 1.00 11.13 C ATOM 1308 C LEU A 84 -9.336 7.915 4.532 1.00 11.30 C ATOM 1309 O LEU A 84 -9.276 6.818 5.098 1.00 42.20 O ATOM 1310 CB LEU A 84 -7.568 7.421 2.744 1.00 41.14 C ATOM 1311 CG LEU A 84 -6.147 7.760 2.177 1.00 24.33 C ATOM 1312 CD1 LEU A 84 -5.670 6.677 1.212 1.00 11.50 C ATOM 1313 CD2 LEU A 84 -6.085 9.168 1.530 1.00 52.44 C ATOM 0 H LEU A 84 -6.578 8.016 5.060 1.00 11.23 H new ATOM 0 HA LEU A 84 -8.478 9.314 3.168 1.00 11.13 H new ATOM 0 HB2 LEU A 84 -7.524 6.448 3.234 1.00 41.14 H new ATOM 0 HB3 LEU A 84 -8.262 7.326 1.909 1.00 41.14 H new ATOM 0 HG LEU A 84 -5.463 7.782 3.025 1.00 24.33 H new ATOM 0 HD11 LEU A 84 -4.682 6.937 0.833 1.00 11.50 H new ATOM 0 HD12 LEU A 84 -5.619 5.721 1.734 1.00 11.50 H new ATOM 0 HD13 LEU A 84 -6.369 6.598 0.379 1.00 11.50 H new ATOM 0 HD21 LEU A 84 -5.079 9.352 1.154 1.00 52.44 H new ATOM 0 HD22 LEU A 84 -6.796 9.221 0.706 1.00 52.44 H new ATOM 0 HD23 LEU A 84 -6.337 9.922 2.275 1.00 52.44 H new ATOM 1325 N SER A 85 -10.379 8.738 4.625 1.00 11.45 N ATOM 1326 CA SER A 85 -11.608 8.416 5.349 1.00 52.43 C ATOM 1327 C SER A 85 -12.589 7.682 4.421 1.00 1.43 C ATOM 1328 O SER A 85 -12.979 8.212 3.372 1.00 11.54 O ATOM 1329 CB SER A 85 -12.214 9.724 5.906 1.00 12.13 C ATOM 1330 OG SER A 85 -12.287 10.734 4.908 1.00 61.21 O ATOM 0 H SER A 85 -10.394 9.662 4.193 1.00 11.45 H new ATOM 0 HA SER A 85 -11.393 7.750 6.184 1.00 52.43 H new ATOM 0 HB2 SER A 85 -13.212 9.526 6.297 1.00 12.13 H new ATOM 0 HB3 SER A 85 -11.609 10.079 6.740 1.00 12.13 H new ATOM 0 HG SER A 85 -12.514 10.326 4.046 1.00 61.21 H new ATOM 1336 N PHE A 86 -12.977 6.456 4.814 1.00 4.44 N ATOM 1337 CA PHE A 86 -13.883 5.608 4.021 1.00 51.45 C ATOM 1338 C PHE A 86 -14.660 4.645 4.927 1.00 25.43 C ATOM 1339 O PHE A 86 -14.592 4.725 6.159 1.00 32.31 O ATOM 1340 CB PHE A 86 -13.094 4.826 2.924 1.00 42.15 C ATOM 1341 CG PHE A 86 -11.984 3.898 3.436 1.00 54.13 C ATOM 1342 CD1 PHE A 86 -10.702 4.386 3.681 1.00 40.33 C ATOM 1343 CD2 PHE A 86 -12.225 2.543 3.667 1.00 62.05 C ATOM 1344 CE1 PHE A 86 -9.705 3.555 4.143 1.00 1.35 C ATOM 1345 CE2 PHE A 86 -11.228 1.714 4.126 1.00 5.42 C ATOM 1346 CZ PHE A 86 -9.969 2.218 4.365 1.00 20.24 C ATOM 0 H PHE A 86 -12.672 6.027 5.688 1.00 4.44 H new ATOM 0 HA PHE A 86 -14.603 6.256 3.521 1.00 51.45 H new ATOM 0 HB2 PHE A 86 -13.803 4.231 2.348 1.00 42.15 H new ATOM 0 HB3 PHE A 86 -12.651 5.547 2.237 1.00 42.15 H new ATOM 0 HD1 PHE A 86 -10.487 5.430 3.506 1.00 40.33 H new ATOM 0 HD2 PHE A 86 -13.209 2.139 3.483 1.00 62.05 H new ATOM 0 HE1 PHE A 86 -8.717 3.949 4.331 1.00 1.35 H new ATOM 0 HE2 PHE A 86 -11.433 0.668 4.299 1.00 5.42 H new ATOM 0 HZ PHE A 86 -9.187 1.567 4.727 1.00 20.24 H new ATOM 1356 N ASP A 87 -15.422 3.760 4.283 1.00 62.13 N ATOM 1357 CA ASP A 87 -16.125 2.644 4.932 1.00 34.00 C ATOM 1358 C ASP A 87 -15.642 1.321 4.321 1.00 72.34 C ATOM 1359 O ASP A 87 -15.355 1.251 3.117 1.00 63.13 O ATOM 1360 CB ASP A 87 -17.665 2.797 4.783 1.00 75.11 C ATOM 1361 CG ASP A 87 -18.161 2.835 3.317 1.00 0.11 C ATOM 1362 OD1 ASP A 87 -17.937 3.855 2.631 1.00 73.25 O ATOM 1363 OD2 ASP A 87 -18.767 1.850 2.844 1.00 53.41 O ATOM 0 H ASP A 87 -15.573 3.797 3.275 1.00 62.13 H new ATOM 0 HA ASP A 87 -15.900 2.649 5.998 1.00 34.00 H new ATOM 0 HB2 ASP A 87 -18.152 1.969 5.298 1.00 75.11 H new ATOM 0 HB3 ASP A 87 -17.978 3.713 5.284 1.00 75.11 H new ATOM 1368 N LEU A 88 -15.541 0.284 5.157 1.00 50.34 N ATOM 1369 CA LEU A 88 -15.145 -1.071 4.741 1.00 22.30 C ATOM 1370 C LEU A 88 -15.863 -2.081 5.645 1.00 1.50 C ATOM 1371 O LEU A 88 -15.974 -1.838 6.849 1.00 52.21 O ATOM 1372 CB LEU A 88 -13.607 -1.267 4.832 1.00 53.04 C ATOM 1373 CG LEU A 88 -13.079 -2.678 4.417 1.00 0.34 C ATOM 1374 CD1 LEU A 88 -13.400 -2.997 2.937 1.00 10.54 C ATOM 1375 CD2 LEU A 88 -11.577 -2.812 4.715 1.00 20.21 C ATOM 0 H LEU A 88 -15.734 0.359 6.156 1.00 50.34 H new ATOM 0 HA LEU A 88 -15.428 -1.223 3.700 1.00 22.30 H new ATOM 0 HB2 LEU A 88 -13.126 -0.519 4.202 1.00 53.04 H new ATOM 0 HB3 LEU A 88 -13.294 -1.069 5.857 1.00 53.04 H new ATOM 0 HG LEU A 88 -13.604 -3.419 5.021 1.00 0.34 H new ATOM 0 HD11 LEU A 88 -13.017 -3.986 2.687 1.00 10.54 H new ATOM 0 HD12 LEU A 88 -14.479 -2.977 2.786 1.00 10.54 H new ATOM 0 HD13 LEU A 88 -12.930 -2.253 2.294 1.00 10.54 H new ATOM 0 HD21 LEU A 88 -11.234 -3.803 4.417 1.00 20.21 H new ATOM 0 HD22 LEU A 88 -11.026 -2.054 4.157 1.00 20.21 H new ATOM 0 HD23 LEU A 88 -11.404 -2.674 5.782 1.00 20.21 H new ATOM 1387 N ASP A 89 -16.355 -3.198 5.045 1.00 32.24 N ATOM 1388 CA ASP A 89 -17.066 -4.296 5.756 1.00 61.13 C ATOM 1389 C ASP A 89 -18.458 -3.829 6.253 1.00 75.44 C ATOM 1390 O ASP A 89 -19.495 -4.209 5.691 1.00 72.54 O ATOM 1391 CB ASP A 89 -16.204 -4.888 6.916 1.00 33.41 C ATOM 1392 CG ASP A 89 -16.920 -5.996 7.716 1.00 54.11 C ATOM 1393 OD1 ASP A 89 -16.854 -7.175 7.313 1.00 23.30 O ATOM 1394 OD2 ASP A 89 -17.550 -5.688 8.752 1.00 71.01 O ATOM 0 H ASP A 89 -16.268 -3.363 4.042 1.00 32.24 H new ATOM 0 HA ASP A 89 -17.227 -5.102 5.040 1.00 61.13 H new ATOM 0 HB2 ASP A 89 -15.280 -5.291 6.501 1.00 33.41 H new ATOM 0 HB3 ASP A 89 -15.924 -4.084 7.596 1.00 33.41 H new ATOM 1399 N GLY A 90 -18.453 -3.005 7.302 1.00 55.21 N ATOM 1400 CA GLY A 90 -19.661 -2.396 7.862 1.00 14.15 C ATOM 1401 C GLY A 90 -19.318 -1.326 8.888 1.00 23.42 C ATOM 1402 O GLY A 90 -20.165 -0.924 9.693 1.00 54.31 O ATOM 0 H GLY A 90 -17.600 -2.738 7.793 1.00 55.21 H new ATOM 0 HA2 GLY A 90 -20.254 -1.957 7.060 1.00 14.15 H new ATOM 0 HA3 GLY A 90 -20.276 -3.166 8.328 1.00 14.15 H new ATOM 1406 N GLU A 91 -18.062 -0.851 8.835 1.00 53.45 N ATOM 1407 CA GLU A 91 -17.477 0.077 9.816 1.00 10.22 C ATOM 1408 C GLU A 91 -16.735 1.209 9.074 1.00 35.31 C ATOM 1409 O GLU A 91 -16.307 1.033 7.929 1.00 45.21 O ATOM 1410 CB GLU A 91 -16.493 -0.713 10.737 1.00 23.42 C ATOM 1411 CG GLU A 91 -15.305 -1.354 9.980 1.00 13.32 C ATOM 1412 CD GLU A 91 -14.431 -2.299 10.823 1.00 41.21 C ATOM 1413 OE1 GLU A 91 -13.723 -1.819 11.735 1.00 20.51 O ATOM 1414 OE2 GLU A 91 -14.425 -3.511 10.559 1.00 1.10 O ATOM 0 H GLU A 91 -17.412 -1.108 8.092 1.00 53.45 H new ATOM 0 HA GLU A 91 -18.261 0.520 10.430 1.00 10.22 H new ATOM 0 HB2 GLU A 91 -16.104 -0.039 11.500 1.00 23.42 H new ATOM 0 HB3 GLU A 91 -17.046 -1.496 11.256 1.00 23.42 H new ATOM 0 HG2 GLU A 91 -15.694 -1.909 9.126 1.00 13.32 H new ATOM 0 HG3 GLU A 91 -14.675 -0.558 9.583 1.00 13.32 H new ATOM 1421 N SER A 92 -16.612 2.372 9.721 1.00 24.02 N ATOM 1422 CA SER A 92 -15.789 3.480 9.218 1.00 43.10 C ATOM 1423 C SER A 92 -14.311 3.169 9.490 1.00 31.00 C ATOM 1424 O SER A 92 -13.955 2.833 10.623 1.00 75.43 O ATOM 1425 CB SER A 92 -16.203 4.807 9.899 1.00 51.21 C ATOM 1426 OG SER A 92 -15.463 5.910 9.389 1.00 75.31 O ATOM 0 H SER A 92 -17.078 2.573 10.606 1.00 24.02 H new ATOM 0 HA SER A 92 -15.940 3.591 8.144 1.00 43.10 H new ATOM 0 HB2 SER A 92 -17.268 4.980 9.744 1.00 51.21 H new ATOM 0 HB3 SER A 92 -16.046 4.729 10.975 1.00 51.21 H new ATOM 0 HG SER A 92 -15.750 6.732 9.839 1.00 75.31 H new ATOM 1432 N ARG A 93 -13.464 3.252 8.449 1.00 11.14 N ATOM 1433 CA ARG A 93 -12.025 2.953 8.546 1.00 74.55 C ATOM 1434 C ARG A 93 -11.192 4.124 8.009 1.00 23.50 C ATOM 1435 O ARG A 93 -11.602 4.810 7.064 1.00 4.32 O ATOM 1436 CB ARG A 93 -11.687 1.660 7.749 1.00 74.14 C ATOM 1437 CG ARG A 93 -12.304 0.339 8.277 1.00 30.24 C ATOM 1438 CD ARG A 93 -11.702 -0.133 9.615 1.00 73.54 C ATOM 1439 NE ARG A 93 -12.165 0.650 10.773 1.00 63.44 N ATOM 1440 CZ ARG A 93 -11.373 1.300 11.649 1.00 40.41 C ATOM 1441 NH1 ARG A 93 -10.051 1.266 11.534 1.00 23.34 N ATOM 1442 NH2 ARG A 93 -11.914 1.988 12.642 1.00 35.54 N ATOM 0 H ARG A 93 -13.760 3.530 7.513 1.00 11.14 H new ATOM 0 HA ARG A 93 -11.780 2.800 9.597 1.00 74.55 H new ATOM 0 HB2 ARG A 93 -12.012 1.800 6.718 1.00 74.14 H new ATOM 0 HB3 ARG A 93 -10.603 1.546 7.728 1.00 74.14 H new ATOM 0 HG2 ARG A 93 -13.379 0.473 8.399 1.00 30.24 H new ATOM 0 HG3 ARG A 93 -12.163 -0.442 7.530 1.00 30.24 H new ATOM 0 HD2 ARG A 93 -11.956 -1.182 9.770 1.00 73.54 H new ATOM 0 HD3 ARG A 93 -10.615 -0.074 9.557 1.00 73.54 H new ATOM 0 HE ARG A 93 -13.172 0.705 10.925 1.00 63.44 H new ATOM 0 HH11 ARG A 93 -9.619 0.742 10.773 1.00 23.34 H new ATOM 0 HH12 ARG A 93 -9.468 1.764 12.206 1.00 23.34 H new ATOM 0 HH21 ARG A 93 -12.928 2.026 12.743 1.00 35.54 H new ATOM 0 HH22 ARG A 93 -11.317 2.481 13.306 1.00 35.54 H new ATOM 1456 N ASP A 94 -10.025 4.341 8.631 1.00 74.10 N ATOM 1457 CA ASP A 94 -9.006 5.294 8.150 1.00 21.10 C ATOM 1458 C ASP A 94 -7.759 4.527 7.708 1.00 25.10 C ATOM 1459 O ASP A 94 -7.361 3.564 8.365 1.00 24.55 O ATOM 1460 CB ASP A 94 -8.608 6.302 9.264 1.00 72.25 C ATOM 1461 CG ASP A 94 -9.732 7.274 9.651 1.00 42.41 C ATOM 1462 OD1 ASP A 94 -9.988 8.234 8.895 1.00 30.40 O ATOM 1463 OD2 ASP A 94 -10.344 7.104 10.730 1.00 64.11 O ATOM 0 H ASP A 94 -9.756 3.858 9.489 1.00 74.10 H new ATOM 0 HA ASP A 94 -9.429 5.848 7.312 1.00 21.10 H new ATOM 0 HB2 ASP A 94 -8.299 5.747 10.150 1.00 72.25 H new ATOM 0 HB3 ASP A 94 -7.743 6.876 8.930 1.00 72.25 H new ATOM 1468 N LEU A 95 -7.155 4.955 6.587 1.00 23.01 N ATOM 1469 CA LEU A 95 -5.799 4.538 6.185 1.00 0.52 C ATOM 1470 C LEU A 95 -4.975 5.789 5.920 1.00 22.45 C ATOM 1471 O LEU A 95 -5.344 6.617 5.101 1.00 20.51 O ATOM 1472 CB LEU A 95 -5.812 3.608 4.943 1.00 1.14 C ATOM 1473 CG LEU A 95 -6.388 2.182 5.184 1.00 72.30 C ATOM 1474 CD1 LEU A 95 -6.257 1.324 3.920 1.00 64.43 C ATOM 1475 CD2 LEU A 95 -5.720 1.501 6.395 1.00 34.02 C ATOM 0 H LEU A 95 -7.594 5.602 5.931 1.00 23.01 H new ATOM 0 HA LEU A 95 -5.355 3.956 6.993 1.00 0.52 H new ATOM 0 HB2 LEU A 95 -6.394 4.088 4.156 1.00 1.14 H new ATOM 0 HB3 LEU A 95 -4.792 3.512 4.571 1.00 1.14 H new ATOM 0 HG LEU A 95 -7.448 2.284 5.415 1.00 72.30 H new ATOM 0 HD11 LEU A 95 -6.665 0.331 4.110 1.00 64.43 H new ATOM 0 HD12 LEU A 95 -6.807 1.792 3.104 1.00 64.43 H new ATOM 0 HD13 LEU A 95 -5.205 1.237 3.646 1.00 64.43 H new ATOM 0 HD21 LEU A 95 -6.146 0.507 6.534 1.00 34.02 H new ATOM 0 HD22 LEU A 95 -4.648 1.415 6.218 1.00 34.02 H new ATOM 0 HD23 LEU A 95 -5.893 2.099 7.290 1.00 34.02 H new ATOM 1487 N HIS A 96 -3.855 5.910 6.618 1.00 10.11 N ATOM 1488 CA HIS A 96 -3.036 7.119 6.606 1.00 1.41 C ATOM 1489 C HIS A 96 -2.018 7.019 5.463 1.00 62.40 C ATOM 1490 O HIS A 96 -1.304 6.021 5.345 1.00 74.32 O ATOM 1491 CB HIS A 96 -2.355 7.273 7.989 1.00 13.24 C ATOM 1492 CG HIS A 96 -3.341 7.388 9.138 1.00 62.51 C ATOM 1493 ND1 HIS A 96 -3.547 8.574 9.794 1.00 40.12 N ATOM 1494 CD2 HIS A 96 -4.170 6.447 9.675 1.00 62.55 C ATOM 1495 CE1 HIS A 96 -4.480 8.336 10.696 1.00 53.24 C ATOM 1496 NE2 HIS A 96 -4.893 7.064 10.658 1.00 11.11 N ATOM 0 H HIS A 96 -3.485 5.169 7.213 1.00 10.11 H new ATOM 0 HA HIS A 96 -3.643 8.007 6.432 1.00 1.41 H new ATOM 0 HB2 HIS A 96 -1.705 6.416 8.163 1.00 13.24 H new ATOM 0 HB3 HIS A 96 -1.719 8.158 7.976 1.00 13.24 H new ATOM 0 HD1 HIS A 96 -3.075 9.461 9.620 1.00 40.12 H new ATOM 0 HD2 HIS A 96 -4.242 5.411 9.380 1.00 62.55 H new ATOM 0 HE1 HIS A 96 -4.863 9.077 11.381 1.00 53.24 H new ATOM 1504 N ALA A 97 -1.987 8.056 4.611 1.00 65.23 N ATOM 1505 CA ALA A 97 -1.151 8.098 3.405 1.00 3.21 C ATOM 1506 C ALA A 97 0.087 8.937 3.683 1.00 64.14 C ATOM 1507 O ALA A 97 -0.011 10.106 4.091 1.00 21.14 O ATOM 1508 CB ALA A 97 -1.950 8.667 2.216 1.00 33.43 C ATOM 0 H ALA A 97 -2.549 8.897 4.743 1.00 65.23 H new ATOM 0 HA ALA A 97 -0.841 7.087 3.141 1.00 3.21 H new ATOM 0 HB1 ALA A 97 -1.316 8.691 1.330 1.00 33.43 H new ATOM 0 HB2 ALA A 97 -2.817 8.035 2.024 1.00 33.43 H new ATOM 0 HB3 ALA A 97 -2.283 9.678 2.452 1.00 33.43 H new ATOM 1514 N PHE A 98 1.257 8.323 3.472 1.00 35.52 N ATOM 1515 CA PHE A 98 2.552 8.933 3.771 1.00 43.33 C ATOM 1516 C PHE A 98 3.391 9.007 2.487 1.00 51.33 C ATOM 1517 O PHE A 98 3.022 8.454 1.447 1.00 54.44 O ATOM 1518 CB PHE A 98 3.330 8.090 4.832 1.00 14.02 C ATOM 1519 CG PHE A 98 2.508 7.490 5.979 1.00 33.45 C ATOM 1520 CD1 PHE A 98 2.256 8.208 7.135 1.00 63.42 C ATOM 1521 CD2 PHE A 98 2.024 6.181 5.905 1.00 30.25 C ATOM 1522 CE1 PHE A 98 1.546 7.647 8.177 1.00 25.31 C ATOM 1523 CE2 PHE A 98 1.313 5.621 6.949 1.00 25.05 C ATOM 1524 CZ PHE A 98 1.076 6.356 8.085 1.00 23.44 C ATOM 0 H PHE A 98 1.329 7.382 3.086 1.00 35.52 H new ATOM 0 HA PHE A 98 2.377 9.933 4.169 1.00 43.33 H new ATOM 0 HB2 PHE A 98 3.835 7.275 4.314 1.00 14.02 H new ATOM 0 HB3 PHE A 98 4.106 8.722 5.265 1.00 14.02 H new ATOM 0 HD1 PHE A 98 2.620 9.221 7.223 1.00 63.42 H new ATOM 0 HD2 PHE A 98 2.209 5.597 5.016 1.00 30.25 H new ATOM 0 HE1 PHE A 98 1.358 8.224 9.070 1.00 25.31 H new ATOM 0 HE2 PHE A 98 0.945 4.609 6.872 1.00 25.05 H new ATOM 0 HZ PHE A 98 0.522 5.922 8.904 1.00 23.44 H new ATOM 1534 N ARG A 99 4.521 9.697 2.597 1.00 23.21 N ATOM 1535 CA ARG A 99 5.591 9.728 1.589 1.00 53.14 C ATOM 1536 C ARG A 99 6.857 10.213 2.305 1.00 50.22 C ATOM 1537 O ARG A 99 6.743 11.034 3.225 1.00 35.10 O ATOM 1538 CB ARG A 99 5.200 10.626 0.380 1.00 54.42 C ATOM 1539 CG ARG A 99 4.909 12.117 0.721 1.00 3.34 C ATOM 1540 CD ARG A 99 3.647 12.655 0.026 1.00 4.01 C ATOM 1541 NE ARG A 99 3.686 12.519 -1.448 1.00 10.45 N ATOM 1542 CZ ARG A 99 2.826 13.104 -2.308 1.00 31.32 C ATOM 1543 NH1 ARG A 99 1.848 13.886 -1.877 1.00 52.35 N ATOM 1544 NH2 ARG A 99 2.941 12.880 -3.606 1.00 30.43 N ATOM 0 H ARG A 99 4.731 10.271 3.414 1.00 23.21 H new ATOM 0 HA ARG A 99 5.765 8.740 1.164 1.00 53.14 H new ATOM 0 HB2 ARG A 99 6.006 10.589 -0.353 1.00 54.42 H new ATOM 0 HB3 ARG A 99 4.316 10.201 -0.096 1.00 54.42 H new ATOM 0 HG2 ARG A 99 4.796 12.222 1.800 1.00 3.34 H new ATOM 0 HG3 ARG A 99 5.765 12.725 0.429 1.00 3.34 H new ATOM 0 HD2 ARG A 99 2.775 12.125 0.410 1.00 4.01 H new ATOM 0 HD3 ARG A 99 3.519 13.706 0.284 1.00 4.01 H new ATOM 0 HE ARG A 99 4.422 11.936 -1.846 1.00 10.45 H new ATOM 0 HH11 ARG A 99 1.734 14.056 -0.878 1.00 52.35 H new ATOM 0 HH12 ARG A 99 1.209 14.318 -2.544 1.00 52.35 H new ATOM 0 HH21 ARG A 99 3.678 12.267 -3.954 1.00 30.43 H new ATOM 0 HH22 ARG A 99 2.293 13.320 -4.259 1.00 30.43 H new ATOM 1558 N GLN A 100 8.037 9.686 1.903 1.00 61.33 N ATOM 1559 CA GLN A 100 9.299 9.826 2.669 1.00 35.24 C ATOM 1560 C GLN A 100 9.589 11.282 3.100 1.00 30.02 C ATOM 1561 O GLN A 100 9.422 11.614 4.279 1.00 44.31 O ATOM 1562 CB GLN A 100 10.492 9.228 1.876 1.00 42.22 C ATOM 1563 CG GLN A 100 10.423 7.694 1.650 1.00 31.23 C ATOM 1564 CD GLN A 100 11.746 7.056 1.185 1.00 11.33 C ATOM 1565 OE1 GLN A 100 12.878 7.549 1.679 1.00 75.42 O flip ATOM 1566 NE2 GLN A 100 11.748 6.086 0.429 1.00 51.31 N flip ATOM 0 H GLN A 100 8.142 9.152 1.040 1.00 61.33 H new ATOM 0 HA GLN A 100 9.170 9.257 3.590 1.00 35.24 H new ATOM 0 HB2 GLN A 100 10.548 9.721 0.906 1.00 42.22 H new ATOM 0 HB3 GLN A 100 11.415 9.461 2.406 1.00 42.22 H new ATOM 0 HG2 GLN A 100 10.111 7.216 2.579 1.00 31.23 H new ATOM 0 HG3 GLN A 100 9.652 7.483 0.909 1.00 31.23 H new ATOM 0 HE21 GLN A 100 10.868 5.724 0.062 1.00 51.31 H new ATOM 0 HE22 GLN A 100 12.630 5.643 0.169 1.00 51.31 H new ATOM 1575 N ALA A 101 9.987 12.151 2.153 1.00 52.44 N ATOM 1576 CA ALA A 101 10.254 13.567 2.462 1.00 64.03 C ATOM 1577 C ALA A 101 9.277 14.509 1.732 1.00 33.14 C ATOM 1578 O ALA A 101 8.284 14.955 2.314 1.00 4.31 O ATOM 1579 CB ALA A 101 11.720 13.898 2.116 1.00 33.41 C ATOM 0 H ALA A 101 10.130 11.900 1.175 1.00 52.44 H new ATOM 0 HA ALA A 101 10.095 13.726 3.529 1.00 64.03 H new ATOM 0 HB1 ALA A 101 11.920 14.945 2.344 1.00 33.41 H new ATOM 0 HB2 ALA A 101 12.384 13.265 2.704 1.00 33.41 H new ATOM 0 HB3 ALA A 101 11.893 13.718 1.055 1.00 33.41 H new ATOM 1585 N ALA A 102 9.536 14.762 0.434 1.00 52.51 N ATOM 1586 CA ALA A 102 8.858 15.829 -0.336 1.00 64.15 C ATOM 1587 C ALA A 102 8.337 15.319 -1.691 1.00 41.54 C ATOM 1588 O ALA A 102 8.416 16.044 -2.700 1.00 63.52 O ATOM 1589 CB ALA A 102 9.855 16.996 -0.522 1.00 30.24 C ATOM 0 H ALA A 102 10.219 14.235 -0.111 1.00 52.51 H new ATOM 0 HA ALA A 102 7.982 16.170 0.215 1.00 64.15 H new ATOM 0 HB1 ALA A 102 9.377 17.796 -1.088 1.00 30.24 H new ATOM 0 HB2 ALA A 102 10.159 17.374 0.454 1.00 30.24 H new ATOM 0 HB3 ALA A 102 10.732 16.642 -1.064 1.00 30.24 H new ATOM 1595 N ASP A 103 7.796 14.084 -1.729 1.00 21.32 N ATOM 1596 CA ASP A 103 7.358 13.456 -2.996 1.00 5.34 C ATOM 1597 C ASP A 103 6.182 14.238 -3.617 1.00 24.33 C ATOM 1598 O ASP A 103 5.333 14.769 -2.904 1.00 35.14 O ATOM 1599 CB ASP A 103 6.949 11.970 -2.778 1.00 21.22 C ATOM 1600 CG ASP A 103 6.414 11.286 -4.058 1.00 10.44 C ATOM 1601 OD1 ASP A 103 7.226 10.849 -4.893 1.00 63.14 O ATOM 1602 OD2 ASP A 103 5.183 11.219 -4.253 1.00 12.22 O ATOM 0 H ASP A 103 7.652 13.503 -0.903 1.00 21.32 H new ATOM 0 HA ASP A 103 8.203 13.483 -3.684 1.00 5.34 H new ATOM 0 HB2 ASP A 103 7.811 11.414 -2.411 1.00 21.22 H new ATOM 0 HB3 ASP A 103 6.185 11.921 -2.002 1.00 21.22 H new ATOM 1607 N GLU A 104 6.175 14.300 -4.952 1.00 0.04 N ATOM 1608 CA GLU A 104 5.071 14.870 -5.746 1.00 51.13 C ATOM 1609 C GLU A 104 4.880 14.034 -7.028 1.00 4.30 C ATOM 1610 O GLU A 104 4.153 14.426 -7.940 1.00 14.34 O ATOM 1611 CB GLU A 104 5.365 16.360 -6.073 1.00 33.13 C ATOM 1612 CG GLU A 104 6.685 16.591 -6.835 1.00 71.34 C ATOM 1613 CD GLU A 104 6.982 18.070 -7.098 1.00 25.13 C ATOM 1614 OE1 GLU A 104 7.544 18.739 -6.209 1.00 1.34 O ATOM 1615 OE2 GLU A 104 6.649 18.576 -8.186 1.00 10.13 O ATOM 0 H GLU A 104 6.945 13.952 -5.524 1.00 0.04 H new ATOM 0 HA GLU A 104 4.144 14.835 -5.173 1.00 51.13 H new ATOM 0 HB2 GLU A 104 4.542 16.760 -6.665 1.00 33.13 H new ATOM 0 HB3 GLU A 104 5.392 16.926 -5.142 1.00 33.13 H new ATOM 0 HG2 GLU A 104 7.507 16.159 -6.264 1.00 71.34 H new ATOM 0 HG3 GLU A 104 6.645 16.061 -7.787 1.00 71.34 H new ATOM 1622 N SER A 105 5.510 12.838 -7.053 1.00 71.53 N ATOM 1623 CA SER A 105 5.439 11.878 -8.177 1.00 55.12 C ATOM 1624 C SER A 105 4.228 10.920 -8.003 1.00 5.42 C ATOM 1625 O SER A 105 4.161 9.859 -8.637 1.00 62.43 O ATOM 1626 CB SER A 105 6.783 11.109 -8.252 1.00 54.42 C ATOM 1627 OG SER A 105 6.837 10.222 -9.358 1.00 33.24 O ATOM 0 H SER A 105 6.090 12.508 -6.282 1.00 71.53 H new ATOM 0 HA SER A 105 5.284 12.408 -9.117 1.00 55.12 H new ATOM 0 HB2 SER A 105 7.604 11.823 -8.322 1.00 54.42 H new ATOM 0 HB3 SER A 105 6.928 10.546 -7.330 1.00 54.42 H new ATOM 0 HG SER A 105 5.948 9.840 -9.515 1.00 33.24 H new ATOM 1633 N ARG A 106 3.293 11.331 -7.110 1.00 11.32 N ATOM 1634 CA ARG A 106 2.004 10.654 -6.829 1.00 52.14 C ATOM 1635 C ARG A 106 2.216 9.357 -6.035 1.00 14.34 C ATOM 1636 O ARG A 106 1.291 8.583 -5.865 1.00 73.30 O ATOM 1637 CB ARG A 106 1.162 10.373 -8.126 1.00 44.53 C ATOM 1638 CG ARG A 106 0.975 11.585 -9.070 1.00 34.22 C ATOM 1639 CD ARG A 106 0.449 12.836 -8.359 1.00 41.14 C ATOM 1640 NE ARG A 106 0.342 13.989 -9.279 1.00 14.41 N ATOM 1641 CZ ARG A 106 0.880 15.207 -9.070 1.00 44.25 C ATOM 1642 NH1 ARG A 106 1.580 15.463 -7.971 1.00 35.32 N ATOM 1643 NH2 ARG A 106 0.698 16.171 -9.962 1.00 23.12 N ATOM 0 H ARG A 106 3.421 12.172 -6.547 1.00 11.32 H new ATOM 0 HA ARG A 106 1.426 11.349 -6.219 1.00 52.14 H new ATOM 0 HB2 ARG A 106 1.643 9.570 -8.684 1.00 44.53 H new ATOM 0 HB3 ARG A 106 0.178 10.010 -7.829 1.00 44.53 H new ATOM 0 HG2 ARG A 106 1.929 11.819 -9.542 1.00 34.22 H new ATOM 0 HG3 ARG A 106 0.284 11.312 -9.867 1.00 34.22 H new ATOM 0 HD2 ARG A 106 -0.529 12.624 -7.927 1.00 41.14 H new ATOM 0 HD3 ARG A 106 1.113 13.091 -7.533 1.00 41.14 H new ATOM 0 HE ARG A 106 -0.182 13.851 -10.143 1.00 14.41 H new ATOM 0 HH11 ARG A 106 1.716 14.733 -7.272 1.00 35.32 H new ATOM 0 HH12 ARG A 106 1.981 16.389 -7.826 1.00 35.32 H new ATOM 0 HH21 ARG A 106 0.152 15.990 -10.804 1.00 23.12 H new ATOM 0 HH22 ARG A 106 1.104 17.094 -9.806 1.00 23.12 H new ATOM 1657 N THR A 107 3.422 9.159 -5.503 1.00 3.11 N ATOM 1658 CA THR A 107 3.784 7.914 -4.823 1.00 33.33 C ATOM 1659 C THR A 107 3.469 8.038 -3.321 1.00 40.35 C ATOM 1660 O THR A 107 4.193 8.691 -2.553 1.00 11.41 O ATOM 1661 CB THR A 107 5.280 7.557 -5.074 1.00 32.32 C ATOM 1662 OG1 THR A 107 5.514 7.503 -6.495 1.00 65.32 O ATOM 1663 CG2 THR A 107 5.674 6.209 -4.443 1.00 41.05 C ATOM 0 H THR A 107 4.171 9.851 -5.530 1.00 3.11 H new ATOM 0 HA THR A 107 3.191 7.095 -5.231 1.00 33.33 H new ATOM 0 HB THR A 107 5.891 8.329 -4.606 1.00 32.32 H new ATOM 0 HG1 THR A 107 6.453 7.281 -6.664 1.00 65.32 H new ATOM 0 HG21 THR A 107 6.725 6.006 -4.646 1.00 41.05 H new ATOM 0 HG22 THR A 107 5.514 6.251 -3.366 1.00 41.05 H new ATOM 0 HG23 THR A 107 5.062 5.415 -4.870 1.00 41.05 H new ATOM 1671 N LEU A 108 2.330 7.448 -2.947 1.00 33.14 N ATOM 1672 CA LEU A 108 1.827 7.406 -1.570 1.00 74.01 C ATOM 1673 C LEU A 108 1.909 5.976 -1.053 1.00 12.42 C ATOM 1674 O LEU A 108 1.545 5.036 -1.757 1.00 2.04 O ATOM 1675 CB LEU A 108 0.369 7.921 -1.521 1.00 51.02 C ATOM 1676 CG LEU A 108 0.180 9.410 -1.930 1.00 33.13 C ATOM 1677 CD1 LEU A 108 -1.306 9.774 -2.025 1.00 1.42 C ATOM 1678 CD2 LEU A 108 0.923 10.348 -0.956 1.00 5.43 C ATOM 0 H LEU A 108 1.716 6.974 -3.610 1.00 33.14 H new ATOM 0 HA LEU A 108 2.436 8.051 -0.936 1.00 74.01 H new ATOM 0 HB2 LEU A 108 -0.241 7.300 -2.177 1.00 51.02 H new ATOM 0 HB3 LEU A 108 -0.013 7.787 -0.509 1.00 51.02 H new ATOM 0 HG LEU A 108 0.616 9.543 -2.920 1.00 33.13 H new ATOM 0 HD11 LEU A 108 -1.407 10.821 -2.313 1.00 1.42 H new ATOM 0 HD12 LEU A 108 -1.788 9.144 -2.773 1.00 1.42 H new ATOM 0 HD13 LEU A 108 -1.782 9.616 -1.057 1.00 1.42 H new ATOM 0 HD21 LEU A 108 0.775 11.383 -1.264 1.00 5.43 H new ATOM 0 HD22 LEU A 108 0.532 10.210 0.052 1.00 5.43 H new ATOM 0 HD23 LEU A 108 1.988 10.115 -0.967 1.00 5.43 H new ATOM 1690 N PHE A 109 2.380 5.825 0.179 1.00 43.23 N ATOM 1691 CA PHE A 109 2.579 4.523 0.808 1.00 53.21 C ATOM 1692 C PHE A 109 1.571 4.385 1.952 1.00 51.20 C ATOM 1693 O PHE A 109 1.614 5.154 2.919 1.00 74.25 O ATOM 1694 CB PHE A 109 4.047 4.418 1.304 1.00 13.21 C ATOM 1695 CG PHE A 109 4.471 3.032 1.803 1.00 35.45 C ATOM 1696 CD1 PHE A 109 4.529 1.945 0.928 1.00 44.23 C ATOM 1697 CD2 PHE A 109 4.831 2.821 3.136 1.00 31.00 C ATOM 1698 CE1 PHE A 109 4.929 0.695 1.371 1.00 4.41 C ATOM 1699 CE2 PHE A 109 5.228 1.572 3.579 1.00 33.10 C ATOM 1700 CZ PHE A 109 5.277 0.511 2.697 1.00 44.12 C ATOM 0 H PHE A 109 2.637 6.611 0.776 1.00 43.23 H new ATOM 0 HA PHE A 109 2.412 3.709 0.103 1.00 53.21 H new ATOM 0 HB2 PHE A 109 4.710 4.712 0.490 1.00 13.21 H new ATOM 0 HB3 PHE A 109 4.193 5.137 2.110 1.00 13.21 H new ATOM 0 HD1 PHE A 109 4.258 2.081 -0.109 1.00 44.23 H new ATOM 0 HD2 PHE A 109 4.799 3.646 3.832 1.00 31.00 H new ATOM 0 HE1 PHE A 109 4.969 -0.135 0.682 1.00 4.41 H new ATOM 0 HE2 PHE A 109 5.499 1.427 4.614 1.00 33.10 H new ATOM 0 HZ PHE A 109 5.587 -0.464 3.043 1.00 44.12 H new ATOM 1710 N VAL A 110 0.633 3.435 1.804 1.00 1.32 N ATOM 1711 CA VAL A 110 -0.384 3.115 2.827 1.00 50.51 C ATOM 1712 C VAL A 110 -0.234 1.645 3.280 1.00 4.23 C ATOM 1713 O VAL A 110 -0.803 0.729 2.671 1.00 3.01 O ATOM 1714 CB VAL A 110 -1.871 3.394 2.332 1.00 32.41 C ATOM 1715 CG1 VAL A 110 -2.218 4.891 2.372 1.00 21.15 C ATOM 1716 CG2 VAL A 110 -2.120 2.833 0.914 1.00 13.31 C ATOM 0 H VAL A 110 0.556 2.861 0.964 1.00 1.32 H new ATOM 0 HA VAL A 110 -0.207 3.780 3.672 1.00 50.51 H new ATOM 0 HB VAL A 110 -2.527 2.872 3.028 1.00 32.41 H new ATOM 0 HG11 VAL A 110 -3.241 5.037 2.026 1.00 21.15 H new ATOM 0 HG12 VAL A 110 -2.124 5.259 3.394 1.00 21.15 H new ATOM 0 HG13 VAL A 110 -1.535 5.440 1.724 1.00 21.15 H new ATOM 0 HG21 VAL A 110 -3.146 3.045 0.614 1.00 13.31 H new ATOM 0 HG22 VAL A 110 -1.432 3.303 0.211 1.00 13.31 H new ATOM 0 HG23 VAL A 110 -1.957 1.755 0.915 1.00 13.31 H new ATOM 1726 N PRO A 111 0.586 1.375 4.336 1.00 31.44 N ATOM 1727 CA PRO A 111 0.585 0.061 4.988 1.00 52.24 C ATOM 1728 C PRO A 111 -0.683 -0.070 5.849 1.00 21.51 C ATOM 1729 O PRO A 111 -0.997 0.841 6.623 1.00 25.34 O ATOM 1730 CB PRO A 111 1.883 0.087 5.839 1.00 24.14 C ATOM 1731 CG PRO A 111 2.127 1.536 6.148 1.00 4.25 C ATOM 1732 CD PRO A 111 1.562 2.314 4.971 1.00 12.10 C ATOM 0 HA PRO A 111 0.572 -0.789 4.306 1.00 52.24 H new ATOM 0 HB2 PRO A 111 1.766 -0.495 6.753 1.00 24.14 H new ATOM 0 HB3 PRO A 111 2.721 -0.345 5.291 1.00 24.14 H new ATOM 0 HG2 PRO A 111 1.638 1.825 7.078 1.00 4.25 H new ATOM 0 HG3 PRO A 111 3.191 1.735 6.273 1.00 4.25 H new ATOM 0 HD2 PRO A 111 1.074 3.232 5.299 1.00 12.10 H new ATOM 0 HD3 PRO A 111 2.347 2.603 4.272 1.00 12.10 H new ATOM 1740 N PHE A 112 -1.442 -1.162 5.682 1.00 11.30 N ATOM 1741 CA PHE A 112 -2.624 -1.431 6.520 1.00 50.10 C ATOM 1742 C PHE A 112 -2.427 -2.741 7.273 1.00 22.02 C ATOM 1743 O PHE A 112 -1.605 -3.577 6.885 1.00 3.21 O ATOM 1744 CB PHE A 112 -3.954 -1.418 5.704 1.00 61.44 C ATOM 1745 CG PHE A 112 -4.282 -2.620 4.806 1.00 54.05 C ATOM 1746 CD1 PHE A 112 -3.907 -2.646 3.467 1.00 4.14 C ATOM 1747 CD2 PHE A 112 -5.038 -3.695 5.292 1.00 12.24 C ATOM 1748 CE1 PHE A 112 -4.272 -3.702 2.647 1.00 32.24 C ATOM 1749 CE2 PHE A 112 -5.393 -4.751 4.475 1.00 30.33 C ATOM 1750 CZ PHE A 112 -5.012 -4.753 3.150 1.00 75.21 C ATOM 0 H PHE A 112 -1.260 -1.874 4.975 1.00 11.30 H new ATOM 0 HA PHE A 112 -2.720 -0.621 7.243 1.00 50.10 H new ATOM 0 HB2 PHE A 112 -4.775 -1.301 6.412 1.00 61.44 H new ATOM 0 HB3 PHE A 112 -3.947 -0.528 5.075 1.00 61.44 H new ATOM 0 HD1 PHE A 112 -3.324 -1.833 3.061 1.00 4.14 H new ATOM 0 HD2 PHE A 112 -5.349 -3.698 6.326 1.00 12.24 H new ATOM 0 HE1 PHE A 112 -3.976 -3.703 1.608 1.00 32.24 H new ATOM 0 HE2 PHE A 112 -5.968 -5.574 4.874 1.00 30.33 H new ATOM 0 HZ PHE A 112 -5.292 -5.575 2.507 1.00 75.21 H new ATOM 1760 N ARG A 113 -3.176 -2.922 8.357 1.00 53.13 N ATOM 1761 CA ARG A 113 -3.093 -4.134 9.171 1.00 72.21 C ATOM 1762 C ARG A 113 -4.500 -4.568 9.562 1.00 60.43 C ATOM 1763 O ARG A 113 -5.201 -3.839 10.260 1.00 43.55 O ATOM 1764 CB ARG A 113 -2.207 -3.891 10.420 1.00 60.34 C ATOM 1765 CG ARG A 113 -1.836 -5.188 11.158 1.00 64.45 C ATOM 1766 CD ARG A 113 -0.889 -4.967 12.341 1.00 34.42 C ATOM 1767 NE ARG A 113 -0.352 -6.249 12.842 1.00 73.52 N ATOM 1768 CZ ARG A 113 0.852 -6.409 13.412 1.00 61.34 C ATOM 1769 NH1 ARG A 113 1.665 -5.371 13.583 1.00 73.32 N ATOM 1770 NH2 ARG A 113 1.242 -7.615 13.800 1.00 70.13 N ATOM 0 H ARG A 113 -3.854 -2.239 8.695 1.00 53.13 H new ATOM 0 HA ARG A 113 -2.627 -4.933 8.595 1.00 72.21 H new ATOM 0 HB2 ARG A 113 -1.294 -3.379 10.116 1.00 60.34 H new ATOM 0 HB3 ARG A 113 -2.732 -3.227 11.107 1.00 60.34 H new ATOM 0 HG2 ARG A 113 -2.747 -5.666 11.517 1.00 64.45 H new ATOM 0 HG3 ARG A 113 -1.370 -5.877 10.454 1.00 64.45 H new ATOM 0 HD2 ARG A 113 -0.067 -4.320 12.036 1.00 34.42 H new ATOM 0 HD3 ARG A 113 -1.419 -4.453 13.143 1.00 34.42 H new ATOM 0 HE ARG A 113 -0.942 -7.076 12.747 1.00 73.52 H new ATOM 0 HH11 ARG A 113 1.376 -4.441 13.280 1.00 73.32 H new ATOM 0 HH12 ARG A 113 2.578 -5.505 14.018 1.00 73.32 H new ATOM 0 HH21 ARG A 113 0.627 -8.418 13.665 1.00 70.13 H new ATOM 0 HH22 ARG A 113 2.157 -7.740 14.234 1.00 70.13 H new ATOM 1784 N ASP A 114 -4.905 -5.754 9.103 1.00 60.54 N ATOM 1785 CA ASP A 114 -6.265 -6.268 9.282 1.00 53.01 C ATOM 1786 C ASP A 114 -6.203 -7.573 10.111 1.00 74.50 C ATOM 1787 O ASP A 114 -5.170 -7.862 10.732 1.00 21.44 O ATOM 1788 CB ASP A 114 -6.906 -6.472 7.881 1.00 62.24 C ATOM 1789 CG ASP A 114 -6.378 -7.707 7.145 1.00 25.11 C ATOM 1790 OD1 ASP A 114 -5.157 -7.791 6.894 1.00 73.12 O ATOM 1791 OD2 ASP A 114 -7.173 -8.618 6.864 1.00 65.24 O ATOM 0 H ASP A 114 -4.293 -6.390 8.592 1.00 60.54 H new ATOM 0 HA ASP A 114 -6.891 -5.565 9.832 1.00 53.01 H new ATOM 0 HB2 ASP A 114 -7.987 -6.559 7.993 1.00 62.24 H new ATOM 0 HB3 ASP A 114 -6.719 -5.588 7.272 1.00 62.24 H new ATOM 1796 N LYS A 115 -7.288 -8.369 10.103 1.00 10.23 N ATOM 1797 CA LYS A 115 -7.387 -9.578 10.942 1.00 31.13 C ATOM 1798 C LYS A 115 -6.849 -10.841 10.236 1.00 33.22 C ATOM 1799 O LYS A 115 -6.895 -11.929 10.816 1.00 61.34 O ATOM 1800 CB LYS A 115 -8.849 -9.782 11.410 1.00 32.23 C ATOM 1801 CG LYS A 115 -9.484 -8.557 12.118 1.00 54.44 C ATOM 1802 CD LYS A 115 -8.681 -7.990 13.317 1.00 21.24 C ATOM 1803 CE LYS A 115 -8.638 -8.921 14.549 1.00 1.15 C ATOM 1804 NZ LYS A 115 -7.768 -10.110 14.353 1.00 24.34 N ATOM 0 H LYS A 115 -8.110 -8.196 9.524 1.00 10.23 H new ATOM 0 HA LYS A 115 -6.751 -9.421 11.813 1.00 31.13 H new ATOM 0 HB2 LYS A 115 -9.460 -10.040 10.545 1.00 32.23 H new ATOM 0 HB3 LYS A 115 -8.882 -10.634 12.089 1.00 32.23 H new ATOM 0 HG2 LYS A 115 -9.616 -7.763 11.383 1.00 54.44 H new ATOM 0 HG3 LYS A 115 -10.478 -8.836 12.468 1.00 54.44 H new ATOM 0 HD2 LYS A 115 -7.660 -7.788 12.993 1.00 21.24 H new ATOM 0 HD3 LYS A 115 -9.116 -7.035 13.612 1.00 21.24 H new ATOM 0 HE2 LYS A 115 -8.282 -8.356 15.411 1.00 1.15 H new ATOM 0 HE3 LYS A 115 -9.650 -9.253 14.781 1.00 1.15 H new ATOM 0 HZ1 LYS A 115 -7.383 -10.413 15.270 1.00 24.34 H new ATOM 0 HZ2 LYS A 115 -8.326 -10.884 13.939 1.00 24.34 H new ATOM 0 HZ3 LYS A 115 -6.986 -9.866 13.712 1.00 24.34 H new ATOM 1818 N THR A 116 -6.362 -10.714 8.983 1.00 15.02 N ATOM 1819 CA THR A 116 -5.609 -11.808 8.322 1.00 21.22 C ATOM 1820 C THR A 116 -4.128 -11.740 8.735 1.00 33.04 C ATOM 1821 O THR A 116 -3.421 -12.759 8.728 1.00 44.33 O ATOM 1822 CB THR A 116 -5.724 -11.798 6.756 1.00 53.01 C ATOM 1823 OG1 THR A 116 -5.050 -10.659 6.193 1.00 14.30 O ATOM 1824 CG2 THR A 116 -7.191 -11.822 6.291 1.00 31.24 C ATOM 0 H THR A 116 -6.473 -9.876 8.412 1.00 15.02 H new ATOM 0 HA THR A 116 -6.061 -12.741 8.658 1.00 21.22 H new ATOM 0 HB THR A 116 -5.239 -12.706 6.398 1.00 53.01 H new ATOM 0 HG1 THR A 116 -5.136 -10.678 5.217 1.00 14.30 H new ATOM 0 HG21 THR A 116 -7.228 -11.814 5.202 1.00 31.24 H new ATOM 0 HG22 THR A 116 -7.676 -12.724 6.664 1.00 31.24 H new ATOM 0 HG23 THR A 116 -7.710 -10.945 6.678 1.00 31.24 H new ATOM 1832 N THR A 117 -3.678 -10.526 9.103 1.00 32.23 N ATOM 1833 CA THR A 117 -2.322 -10.294 9.607 1.00 43.03 C ATOM 1834 C THR A 117 -2.183 -10.897 11.024 1.00 3.54 C ATOM 1835 O THR A 117 -3.063 -10.716 11.873 1.00 75.25 O ATOM 1836 CB THR A 117 -1.977 -8.771 9.634 1.00 12.15 C ATOM 1837 OG1 THR A 117 -2.141 -8.205 8.318 1.00 72.42 O ATOM 1838 CG2 THR A 117 -0.533 -8.520 10.117 1.00 64.11 C ATOM 0 H THR A 117 -4.248 -9.682 9.057 1.00 32.23 H new ATOM 0 HA THR A 117 -1.619 -10.782 8.932 1.00 43.03 H new ATOM 0 HB THR A 117 -2.661 -8.293 10.336 1.00 12.15 H new ATOM 0 HG1 THR A 117 -1.925 -7.250 8.344 1.00 72.42 H new ATOM 0 HG21 THR A 117 -0.332 -7.449 10.122 1.00 64.11 H new ATOM 0 HG22 THR A 117 -0.413 -8.916 11.125 1.00 64.11 H new ATOM 0 HG23 THR A 117 0.167 -9.018 9.446 1.00 64.11 H new ATOM 1846 N GLY A 118 -1.079 -11.631 11.237 1.00 2.01 N ATOM 1847 CA GLY A 118 -0.835 -12.370 12.475 1.00 62.25 C ATOM 1848 C GLY A 118 -1.755 -13.573 12.682 1.00 24.13 C ATOM 1849 O GLY A 118 -1.597 -14.297 13.671 1.00 72.31 O ATOM 0 H GLY A 118 -0.331 -11.725 10.550 1.00 2.01 H new ATOM 0 HA2 GLY A 118 0.199 -12.713 12.481 1.00 62.25 H new ATOM 0 HA3 GLY A 118 -0.950 -11.690 13.319 1.00 62.25 H new ATOM 1853 N GLN A 119 -2.715 -13.804 11.751 1.00 1.54 N ATOM 1854 CA GLN A 119 -3.753 -14.843 11.906 1.00 24.05 C ATOM 1855 C GLN A 119 -3.845 -15.732 10.638 1.00 74.12 C ATOM 1856 O GLN A 119 -3.249 -16.811 10.588 1.00 60.25 O ATOM 1857 CB GLN A 119 -5.144 -14.207 12.234 1.00 34.33 C ATOM 1858 CG GLN A 119 -5.254 -13.444 13.578 1.00 55.32 C ATOM 1859 CD GLN A 119 -5.110 -14.337 14.819 1.00 64.41 C ATOM 1860 OE1 GLN A 119 -6.086 -14.918 15.299 1.00 54.04 O ATOM 1861 NE2 GLN A 119 -3.910 -14.415 15.374 1.00 24.42 N ATOM 0 H GLN A 119 -2.787 -13.278 10.880 1.00 1.54 H new ATOM 0 HA GLN A 119 -3.464 -15.475 12.745 1.00 24.05 H new ATOM 0 HB2 GLN A 119 -5.404 -13.520 11.429 1.00 34.33 H new ATOM 0 HB3 GLN A 119 -5.892 -15.000 12.229 1.00 34.33 H new ATOM 0 HG2 GLN A 119 -4.486 -12.671 13.609 1.00 55.32 H new ATOM 0 HG3 GLN A 119 -6.218 -12.937 13.618 1.00 55.32 H new ATOM 0 HE21 GLN A 119 -3.121 -13.923 14.954 1.00 24.42 H new ATOM 0 HE22 GLN A 119 -3.775 -14.967 16.221 1.00 24.42 H new ATOM 1870 N GLN A 120 -4.576 -15.254 9.610 1.00 1.40 N ATOM 1871 CA GLN A 120 -4.958 -16.074 8.430 1.00 31.24 C ATOM 1872 C GLN A 120 -3.870 -16.121 7.334 1.00 31.15 C ATOM 1873 O GLN A 120 -4.087 -16.746 6.288 1.00 74.42 O ATOM 1874 CB GLN A 120 -6.283 -15.537 7.818 1.00 75.20 C ATOM 1875 CG GLN A 120 -7.486 -15.505 8.785 1.00 34.13 C ATOM 1876 CD GLN A 120 -8.792 -15.051 8.120 1.00 35.42 C ATOM 1877 OE1 GLN A 120 -9.009 -15.262 6.925 1.00 52.24 O ATOM 1878 NE2 GLN A 120 -9.667 -14.426 8.884 1.00 43.04 N ATOM 0 H GLN A 120 -4.919 -14.294 9.569 1.00 1.40 H new ATOM 0 HA GLN A 120 -5.086 -17.093 8.794 1.00 31.24 H new ATOM 0 HB2 GLN A 120 -6.110 -14.528 7.445 1.00 75.20 H new ATOM 0 HB3 GLN A 120 -6.544 -16.154 6.958 1.00 75.20 H new ATOM 0 HG2 GLN A 120 -7.629 -16.499 9.208 1.00 34.13 H new ATOM 0 HG3 GLN A 120 -7.258 -14.836 9.615 1.00 34.13 H new ATOM 0 HE21 GLN A 120 -9.460 -14.265 9.870 1.00 43.04 H new ATOM 0 HE22 GLN A 120 -10.550 -14.103 8.489 1.00 43.04 H new ATOM 1887 N SER A 121 -2.704 -15.508 7.594 1.00 72.12 N ATOM 1888 CA SER A 121 -1.637 -15.334 6.581 1.00 74.12 C ATOM 1889 C SER A 121 -0.405 -14.699 7.238 1.00 10.41 C ATOM 1890 O SER A 121 0.188 -13.751 6.692 1.00 40.02 O ATOM 1891 CB SER A 121 -2.143 -14.500 5.367 1.00 73.25 C ATOM 1892 OG SER A 121 -2.813 -13.331 5.797 1.00 21.01 O ATOM 0 H SER A 121 -2.470 -15.119 8.507 1.00 72.12 H new ATOM 0 HA SER A 121 -1.353 -16.311 6.190 1.00 74.12 H new ATOM 0 HB2 SER A 121 -1.300 -14.227 4.732 1.00 73.25 H new ATOM 0 HB3 SER A 121 -2.816 -15.106 4.760 1.00 73.25 H new ATOM 0 HG SER A 121 -2.892 -13.340 6.774 1.00 21.01 H new ATOM 1898 N TYR A 122 -0.020 -15.277 8.409 1.00 23.44 N ATOM 1899 CA TYR A 122 1.151 -14.878 9.254 1.00 43.13 C ATOM 1900 C TYR A 122 1.315 -13.344 9.478 1.00 4.25 C ATOM 1901 O TYR A 122 0.482 -12.530 9.055 1.00 71.24 O ATOM 1902 CB TYR A 122 2.480 -15.564 8.775 1.00 54.50 C ATOM 1903 CG TYR A 122 2.832 -15.394 7.291 1.00 13.43 C ATOM 1904 CD1 TYR A 122 3.330 -14.189 6.793 1.00 21.54 C ATOM 1905 CD2 TYR A 122 2.644 -16.439 6.387 1.00 74.11 C ATOM 1906 CE1 TYR A 122 3.624 -14.036 5.452 1.00 23.22 C ATOM 1907 CE2 TYR A 122 2.932 -16.289 5.051 1.00 33.25 C ATOM 1908 CZ TYR A 122 3.420 -15.090 4.586 1.00 21.22 C ATOM 1909 OH TYR A 122 3.696 -14.947 3.247 1.00 24.54 O ATOM 0 H TYR A 122 -0.533 -16.063 8.809 1.00 23.44 H new ATOM 0 HA TYR A 122 0.918 -15.263 10.247 1.00 43.13 H new ATOM 0 HB2 TYR A 122 3.303 -15.169 9.370 1.00 54.50 H new ATOM 0 HB3 TYR A 122 2.413 -16.630 8.992 1.00 54.50 H new ATOM 0 HD1 TYR A 122 3.488 -13.361 7.468 1.00 21.54 H new ATOM 0 HD2 TYR A 122 2.265 -17.385 6.743 1.00 74.11 H new ATOM 0 HE1 TYR A 122 4.011 -13.097 5.084 1.00 23.22 H new ATOM 0 HE2 TYR A 122 2.775 -17.111 4.368 1.00 33.25 H new ATOM 0 HH TYR A 122 4.546 -14.472 3.137 1.00 24.54 H new ATOM 1919 N ASP A 123 2.409 -12.970 10.163 1.00 12.02 N ATOM 1920 CA ASP A 123 2.632 -11.599 10.677 1.00 61.53 C ATOM 1921 C ASP A 123 3.311 -10.705 9.600 1.00 23.12 C ATOM 1922 O ASP A 123 3.299 -11.040 8.402 1.00 10.10 O ATOM 1923 CB ASP A 123 3.464 -11.695 12.001 1.00 21.25 C ATOM 1924 CG ASP A 123 3.322 -10.463 12.919 1.00 34.05 C ATOM 1925 OD1 ASP A 123 2.231 -10.269 13.487 1.00 70.22 O ATOM 1926 OD2 ASP A 123 4.287 -9.675 13.051 1.00 13.20 O ATOM 0 H ASP A 123 3.172 -13.612 10.379 1.00 12.02 H new ATOM 0 HA ASP A 123 1.680 -11.119 10.903 1.00 61.53 H new ATOM 0 HB2 ASP A 123 3.153 -12.583 12.551 1.00 21.25 H new ATOM 0 HB3 ASP A 123 4.516 -11.829 11.749 1.00 21.25 H new ATOM 1931 N GLY A 124 3.857 -9.545 10.020 1.00 65.23 N ATOM 1932 CA GLY A 124 4.494 -8.589 9.119 1.00 20.12 C ATOM 1933 C GLY A 124 3.584 -7.402 8.873 1.00 11.32 C ATOM 1934 O GLY A 124 3.828 -6.292 9.368 1.00 41.21 O ATOM 0 H GLY A 124 3.864 -9.253 10.997 1.00 65.23 H new ATOM 0 HA2 GLY A 124 5.437 -8.249 9.548 1.00 20.12 H new ATOM 0 HA3 GLY A 124 4.731 -9.075 8.173 1.00 20.12 H new ATOM 1938 N GLY A 125 2.515 -7.661 8.112 1.00 10.03 N ATOM 1939 CA GLY A 125 1.501 -6.657 7.786 1.00 35.05 C ATOM 1940 C GLY A 125 1.027 -6.785 6.355 1.00 33.33 C ATOM 1941 O GLY A 125 1.433 -7.700 5.636 1.00 1.24 O ATOM 0 H GLY A 125 2.330 -8.577 7.704 1.00 10.03 H new ATOM 0 HA2 GLY A 125 0.652 -6.764 8.461 1.00 35.05 H new ATOM 0 HA3 GLY A 125 1.911 -5.660 7.946 1.00 35.05 H new ATOM 1945 N ARG A 126 0.131 -5.888 5.948 1.00 74.11 N ATOM 1946 CA ARG A 126 -0.294 -5.748 4.548 1.00 62.35 C ATOM 1947 C ARG A 126 0.212 -4.389 4.050 1.00 75.11 C ATOM 1948 O ARG A 126 0.107 -3.389 4.765 1.00 54.52 O ATOM 1949 CB ARG A 126 -1.838 -5.810 4.430 1.00 32.15 C ATOM 1950 CG ARG A 126 -2.545 -7.010 5.109 1.00 2.12 C ATOM 1951 CD ARG A 126 -2.273 -8.384 4.460 1.00 41.05 C ATOM 1952 NE ARG A 126 -1.027 -9.014 4.948 1.00 12.34 N ATOM 1953 CZ ARG A 126 -0.972 -10.127 5.713 1.00 3.20 C ATOM 1954 NH1 ARG A 126 -2.082 -10.758 6.084 1.00 35.04 N ATOM 1955 NH2 ARG A 126 0.205 -10.599 6.110 1.00 70.23 N ATOM 0 H ARG A 126 -0.326 -5.232 6.581 1.00 74.11 H new ATOM 0 HA ARG A 126 0.115 -6.562 3.950 1.00 62.35 H new ATOM 0 HB2 ARG A 126 -2.248 -4.892 4.852 1.00 32.15 H new ATOM 0 HB3 ARG A 126 -2.097 -5.818 3.371 1.00 32.15 H new ATOM 0 HG2 ARG A 126 -2.235 -7.051 6.153 1.00 2.12 H new ATOM 0 HG3 ARG A 126 -3.620 -6.829 5.103 1.00 2.12 H new ATOM 0 HD2 ARG A 126 -3.113 -9.048 4.662 1.00 41.05 H new ATOM 0 HD3 ARG A 126 -2.214 -8.264 3.378 1.00 41.05 H new ATOM 0 HE ARG A 126 -0.143 -8.576 4.688 1.00 12.34 H new ATOM 0 HH11 ARG A 126 -2.992 -10.403 5.791 1.00 35.04 H new ATOM 0 HH12 ARG A 126 -2.023 -11.597 6.661 1.00 35.04 H new ATOM 0 HH21 ARG A 126 1.064 -10.122 5.837 1.00 70.23 H new ATOM 0 HH22 ARG A 126 0.249 -11.439 6.687 1.00 70.23 H new ATOM 1969 N TYR A 127 0.790 -4.342 2.852 1.00 13.10 N ATOM 1970 CA TYR A 127 1.283 -3.079 2.270 1.00 62.01 C ATOM 1971 C TYR A 127 0.487 -2.739 1.025 1.00 71.12 C ATOM 1972 O TYR A 127 0.153 -3.612 0.247 1.00 14.21 O ATOM 1973 CB TYR A 127 2.796 -3.184 1.961 1.00 64.41 C ATOM 1974 CG TYR A 127 3.621 -3.446 3.227 1.00 71.13 C ATOM 1975 CD1 TYR A 127 3.923 -2.414 4.114 1.00 54.15 C ATOM 1976 CD2 TYR A 127 4.043 -4.731 3.564 1.00 51.20 C ATOM 1977 CE1 TYR A 127 4.620 -2.654 5.283 1.00 54.55 C ATOM 1978 CE2 TYR A 127 4.746 -4.965 4.726 1.00 63.33 C ATOM 1979 CZ TYR A 127 5.025 -3.936 5.580 1.00 51.13 C ATOM 1980 OH TYR A 127 5.709 -4.193 6.742 1.00 52.12 O ATOM 0 H TYR A 127 0.932 -5.160 2.259 1.00 13.10 H new ATOM 0 HA TYR A 127 1.147 -2.273 2.991 1.00 62.01 H new ATOM 0 HB2 TYR A 127 2.965 -3.988 1.244 1.00 64.41 H new ATOM 0 HB3 TYR A 127 3.136 -2.261 1.491 1.00 64.41 H new ATOM 0 HD1 TYR A 127 3.606 -1.408 3.883 1.00 54.15 H new ATOM 0 HD2 TYR A 127 3.816 -5.556 2.905 1.00 51.20 H new ATOM 0 HE1 TYR A 127 4.845 -1.842 5.959 1.00 54.55 H new ATOM 0 HE2 TYR A 127 5.077 -5.965 4.962 1.00 63.33 H new ATOM 0 HH TYR A 127 6.673 -4.156 6.569 1.00 52.12 H new ATOM 1990 N MET A 128 0.149 -1.461 0.879 1.00 24.03 N ATOM 1991 CA MET A 128 -0.450 -0.918 -0.345 1.00 72.33 C ATOM 1992 C MET A 128 0.292 0.358 -0.725 1.00 55.21 C ATOM 1993 O MET A 128 0.917 1.013 0.120 1.00 14.43 O ATOM 1994 CB MET A 128 -1.959 -0.607 -0.174 1.00 4.01 C ATOM 1995 CG MET A 128 -2.872 -1.812 0.040 1.00 33.35 C ATOM 1996 SD MET A 128 -4.610 -1.433 -0.230 1.00 41.34 S ATOM 1997 CE MET A 128 -4.806 0.061 0.722 1.00 72.21 C ATOM 0 H MET A 128 0.283 -0.764 1.611 1.00 24.03 H new ATOM 0 HA MET A 128 -0.362 -1.670 -1.129 1.00 72.33 H new ATOM 0 HB2 MET A 128 -2.077 0.068 0.674 1.00 4.01 H new ATOM 0 HB3 MET A 128 -2.301 -0.070 -1.059 1.00 4.01 H new ATOM 0 HG2 MET A 128 -2.571 -2.613 -0.635 1.00 33.35 H new ATOM 0 HG3 MET A 128 -2.741 -2.185 1.056 1.00 33.35 H new ATOM 0 HE1 MET A 128 -5.846 0.159 1.035 1.00 72.21 H new ATOM 0 HE2 MET A 128 -4.165 0.018 1.602 1.00 72.21 H new ATOM 0 HE3 MET A 128 -4.528 0.920 0.112 1.00 72.21 H new ATOM 2007 N GLU A 129 0.228 0.685 -2.008 1.00 34.43 N ATOM 2008 CA GLU A 129 0.779 1.922 -2.556 1.00 73.02 C ATOM 2009 C GLU A 129 -0.228 2.517 -3.540 1.00 4.01 C ATOM 2010 O GLU A 129 -0.724 1.824 -4.439 1.00 22.32 O ATOM 2011 CB GLU A 129 2.112 1.620 -3.262 1.00 64.54 C ATOM 2012 CG GLU A 129 2.771 2.808 -3.992 1.00 13.53 C ATOM 2013 CD GLU A 129 3.990 2.371 -4.818 1.00 21.42 C ATOM 2014 OE1 GLU A 129 3.831 1.484 -5.679 1.00 44.15 O ATOM 2015 OE2 GLU A 129 5.103 2.896 -4.617 1.00 62.21 O ATOM 0 H GLU A 129 -0.214 0.091 -2.710 1.00 34.43 H new ATOM 0 HA GLU A 129 0.965 2.640 -1.757 1.00 73.02 H new ATOM 0 HB2 GLU A 129 2.815 1.238 -2.522 1.00 64.54 H new ATOM 0 HB3 GLU A 129 1.945 0.821 -3.985 1.00 64.54 H new ATOM 0 HG2 GLU A 129 2.040 3.282 -4.647 1.00 13.53 H new ATOM 0 HG3 GLU A 129 3.077 3.557 -3.262 1.00 13.53 H new ATOM 2022 N LEU A 130 -0.534 3.792 -3.340 1.00 54.22 N ATOM 2023 CA LEU A 130 -1.444 4.555 -4.187 1.00 1.05 C ATOM 2024 C LEU A 130 -0.626 5.427 -5.114 1.00 33.20 C ATOM 2025 O LEU A 130 0.288 6.124 -4.661 1.00 43.43 O ATOM 2026 CB LEU A 130 -2.302 5.467 -3.300 1.00 3.52 C ATOM 2027 CG LEU A 130 -3.012 4.758 -2.119 1.00 1.52 C ATOM 2028 CD1 LEU A 130 -3.256 5.754 -0.996 1.00 61.55 C ATOM 2029 CD2 LEU A 130 -4.318 4.063 -2.556 1.00 40.41 C ATOM 0 H LEU A 130 -0.149 4.337 -2.569 1.00 54.22 H new ATOM 0 HA LEU A 130 -2.078 3.877 -4.759 1.00 1.05 H new ATOM 0 HB2 LEU A 130 -1.669 6.259 -2.900 1.00 3.52 H new ATOM 0 HB3 LEU A 130 -3.057 5.947 -3.922 1.00 3.52 H new ATOM 0 HG LEU A 130 -2.357 3.968 -1.753 1.00 1.52 H new ATOM 0 HD11 LEU A 130 -3.755 5.253 -0.167 1.00 61.55 H new ATOM 0 HD12 LEU A 130 -2.303 6.158 -0.655 1.00 61.55 H new ATOM 0 HD13 LEU A 130 -3.885 6.566 -1.360 1.00 61.55 H new ATOM 0 HD21 LEU A 130 -4.779 3.580 -1.694 1.00 40.41 H new ATOM 0 HD22 LEU A 130 -5.004 4.803 -2.968 1.00 40.41 H new ATOM 0 HD23 LEU A 130 -4.095 3.314 -3.315 1.00 40.41 H new ATOM 2041 N GLU A 131 -0.926 5.371 -6.402 1.00 34.43 N ATOM 2042 CA GLU A 131 -0.499 6.389 -7.355 1.00 34.05 C ATOM 2043 C GLU A 131 -1.753 7.046 -7.952 1.00 24.32 C ATOM 2044 O GLU A 131 -2.297 6.556 -8.938 1.00 54.53 O ATOM 2045 CB GLU A 131 0.439 5.755 -8.410 1.00 0.04 C ATOM 2046 CG GLU A 131 1.767 5.245 -7.797 1.00 45.33 C ATOM 2047 CD GLU A 131 2.658 4.493 -8.785 1.00 32.24 C ATOM 2048 OE1 GLU A 131 3.350 5.155 -9.582 1.00 41.43 O ATOM 2049 OE2 GLU A 131 2.693 3.240 -8.761 1.00 13.43 O ATOM 0 H GLU A 131 -1.473 4.618 -6.819 1.00 34.43 H new ATOM 0 HA GLU A 131 0.082 7.175 -6.873 1.00 34.05 H new ATOM 0 HB2 GLU A 131 -0.075 4.925 -8.896 1.00 0.04 H new ATOM 0 HB3 GLU A 131 0.659 6.491 -9.184 1.00 0.04 H new ATOM 0 HG2 GLU A 131 2.321 6.095 -7.398 1.00 45.33 H new ATOM 0 HG3 GLU A 131 1.539 4.589 -6.957 1.00 45.33 H new ATOM 2056 N PRO A 132 -2.296 8.128 -7.289 1.00 44.52 N ATOM 2057 CA PRO A 132 -3.463 8.881 -7.801 1.00 50.33 C ATOM 2058 C PRO A 132 -3.169 9.584 -9.139 1.00 33.52 C ATOM 2059 O PRO A 132 -2.004 9.703 -9.552 1.00 60.10 O ATOM 2060 CB PRO A 132 -3.751 9.908 -6.671 1.00 11.11 C ATOM 2061 CG PRO A 132 -2.449 10.054 -5.951 1.00 61.42 C ATOM 2062 CD PRO A 132 -1.842 8.678 -5.977 1.00 24.03 C ATOM 0 HA PRO A 132 -4.311 8.231 -8.019 1.00 50.33 H new ATOM 0 HB2 PRO A 132 -4.087 10.861 -7.078 1.00 11.11 H new ATOM 0 HB3 PRO A 132 -4.535 9.552 -6.003 1.00 11.11 H new ATOM 0 HG2 PRO A 132 -1.803 10.781 -6.444 1.00 61.42 H new ATOM 0 HG3 PRO A 132 -2.599 10.402 -4.929 1.00 61.42 H new ATOM 0 HD2 PRO A 132 -0.755 8.717 -5.911 1.00 24.03 H new ATOM 0 HD3 PRO A 132 -2.190 8.069 -5.143 1.00 24.03 H new ATOM 2070 N ASP A 133 -4.242 10.053 -9.798 1.00 2.03 N ATOM 2071 CA ASP A 133 -4.155 10.768 -11.080 1.00 72.10 C ATOM 2072 C ASP A 133 -3.385 12.073 -10.872 1.00 42.01 C ATOM 2073 O ASP A 133 -2.364 12.334 -11.510 1.00 22.34 O ATOM 2074 CB ASP A 133 -5.585 11.041 -11.622 1.00 61.04 C ATOM 2075 CG ASP A 133 -5.623 12.073 -12.766 1.00 73.43 C ATOM 2076 OD1 ASP A 133 -5.279 11.720 -13.911 1.00 72.35 O ATOM 2077 OD2 ASP A 133 -5.989 13.250 -12.516 1.00 54.12 O ATOM 0 H ASP A 133 -5.196 9.946 -9.454 1.00 2.03 H new ATOM 0 HA ASP A 133 -3.624 10.163 -11.815 1.00 72.10 H new ATOM 0 HB2 ASP A 133 -6.016 10.104 -11.974 1.00 61.04 H new ATOM 0 HB3 ASP A 133 -6.214 11.394 -10.804 1.00 61.04 H new ATOM 2082 N ARG A 134 -3.898 12.871 -9.943 1.00 1.13 N ATOM 2083 CA ARG A 134 -3.289 14.125 -9.501 1.00 34.55 C ATOM 2084 C ARG A 134 -2.874 13.975 -8.036 1.00 51.24 C ATOM 2085 O ARG A 134 -3.141 12.935 -7.430 1.00 71.00 O ATOM 2086 CB ARG A 134 -4.291 15.295 -9.730 1.00 21.45 C ATOM 2087 CG ARG A 134 -5.786 15.014 -9.388 1.00 44.41 C ATOM 2088 CD ARG A 134 -6.074 14.804 -7.887 1.00 31.22 C ATOM 2089 NE ARG A 134 -7.509 14.872 -7.567 1.00 14.23 N ATOM 2090 CZ ARG A 134 -8.429 13.934 -7.832 1.00 53.23 C ATOM 2091 NH1 ARG A 134 -8.112 12.808 -8.454 1.00 42.25 N ATOM 2092 NH2 ARG A 134 -9.680 14.124 -7.444 1.00 64.30 N ATOM 0 H ARG A 134 -4.772 12.660 -9.462 1.00 1.13 H new ATOM 0 HA ARG A 134 -2.394 14.357 -10.078 1.00 34.55 H new ATOM 0 HB2 ARG A 134 -3.960 16.147 -9.136 1.00 21.45 H new ATOM 0 HB3 ARG A 134 -4.232 15.594 -10.777 1.00 21.45 H new ATOM 0 HG2 ARG A 134 -6.390 15.847 -9.747 1.00 44.41 H new ATOM 0 HG3 ARG A 134 -6.109 14.128 -9.934 1.00 44.41 H new ATOM 0 HD2 ARG A 134 -5.683 13.834 -7.579 1.00 31.22 H new ATOM 0 HD3 ARG A 134 -5.541 15.560 -7.310 1.00 31.22 H new ATOM 0 HE ARG A 134 -7.836 15.716 -7.097 1.00 14.23 H new ATOM 0 HH11 ARG A 134 -7.149 12.639 -8.743 1.00 42.25 H new ATOM 0 HH12 ARG A 134 -8.831 12.110 -8.644 1.00 42.25 H new ATOM 0 HH21 ARG A 134 -9.936 14.978 -6.948 1.00 64.30 H new ATOM 0 HH22 ARG A 134 -10.388 13.417 -7.641 1.00 64.30 H new ATOM 2106 N ASP A 135 -2.233 15.002 -7.454 1.00 75.23 N ATOM 2107 CA ASP A 135 -1.774 14.917 -6.050 1.00 15.43 C ATOM 2108 C ASP A 135 -2.973 15.113 -5.117 1.00 73.32 C ATOM 2109 O ASP A 135 -3.954 15.766 -5.492 1.00 55.24 O ATOM 2110 CB ASP A 135 -0.653 15.944 -5.736 1.00 22.03 C ATOM 2111 CG ASP A 135 0.306 15.442 -4.637 1.00 74.02 C ATOM 2112 OD1 ASP A 135 -0.008 15.590 -3.433 1.00 43.31 O ATOM 2113 OD2 ASP A 135 1.358 14.857 -4.983 1.00 31.42 O ATOM 0 H ASP A 135 -2.022 15.885 -7.919 1.00 75.23 H new ATOM 0 HA ASP A 135 -1.342 13.929 -5.890 1.00 15.43 H new ATOM 0 HB2 ASP A 135 -0.086 16.150 -6.644 1.00 22.03 H new ATOM 0 HB3 ASP A 135 -1.103 16.885 -5.421 1.00 22.03 H new ATOM 2118 N LEU A 136 -2.901 14.541 -3.914 1.00 50.01 N ATOM 2119 CA LEU A 136 -4.022 14.553 -2.969 1.00 41.31 C ATOM 2120 C LEU A 136 -3.866 15.680 -1.944 1.00 73.13 C ATOM 2121 O LEU A 136 -2.859 15.766 -1.240 1.00 4.22 O ATOM 2122 CB LEU A 136 -4.143 13.181 -2.268 1.00 33.42 C ATOM 2123 CG LEU A 136 -4.404 11.958 -3.202 1.00 72.01 C ATOM 2124 CD1 LEU A 136 -4.637 10.680 -2.376 1.00 2.11 C ATOM 2125 CD2 LEU A 136 -5.578 12.214 -4.182 1.00 60.52 C ATOM 0 H LEU A 136 -2.071 14.059 -3.568 1.00 50.01 H new ATOM 0 HA LEU A 136 -4.940 14.739 -3.526 1.00 41.31 H new ATOM 0 HB2 LEU A 136 -3.225 12.998 -1.710 1.00 33.42 H new ATOM 0 HB3 LEU A 136 -4.953 13.237 -1.540 1.00 33.42 H new ATOM 0 HG LEU A 136 -3.510 11.815 -3.809 1.00 72.01 H new ATOM 0 HD11 LEU A 136 -4.817 9.840 -3.048 1.00 2.11 H new ATOM 0 HD12 LEU A 136 -3.757 10.475 -1.767 1.00 2.11 H new ATOM 0 HD13 LEU A 136 -5.503 10.818 -1.728 1.00 2.11 H new ATOM 0 HD21 LEU A 136 -5.724 11.337 -4.812 1.00 60.52 H new ATOM 0 HD22 LEU A 136 -6.489 12.409 -3.616 1.00 60.52 H new ATOM 0 HD23 LEU A 136 -5.348 13.076 -4.808 1.00 60.52 H new ATOM 2137 N SER A 137 -4.880 16.543 -1.882 1.00 24.22 N ATOM 2138 CA SER A 137 -5.022 17.575 -0.850 1.00 30.33 C ATOM 2139 C SER A 137 -6.343 17.329 -0.104 1.00 12.15 C ATOM 2140 O SER A 137 -7.130 16.448 -0.490 1.00 60.02 O ATOM 2141 CB SER A 137 -4.961 18.984 -1.472 1.00 1.53 C ATOM 2142 OG SER A 137 -3.714 19.204 -2.116 1.00 30.31 O ATOM 0 H SER A 137 -5.642 16.546 -2.560 1.00 24.22 H new ATOM 0 HA SER A 137 -4.197 17.518 -0.140 1.00 30.33 H new ATOM 0 HB2 SER A 137 -5.771 19.103 -2.191 1.00 1.53 H new ATOM 0 HB3 SER A 137 -5.111 19.735 -0.696 1.00 1.53 H new ATOM 0 HG SER A 137 -3.700 20.104 -2.504 1.00 30.31 H new ATOM 2148 N ASP A 138 -6.561 18.078 0.979 1.00 53.54 N ATOM 2149 CA ASP A 138 -7.742 17.935 1.839 1.00 33.32 C ATOM 2150 C ASP A 138 -9.039 18.263 1.061 1.00 61.33 C ATOM 2151 O ASP A 138 -9.382 19.426 0.849 1.00 2.24 O ATOM 2152 CB ASP A 138 -7.576 18.811 3.117 1.00 11.31 C ATOM 2153 CG ASP A 138 -7.293 20.304 2.838 1.00 25.32 C ATOM 2154 OD1 ASP A 138 -6.179 20.631 2.374 1.00 73.44 O ATOM 2155 OD2 ASP A 138 -8.179 21.149 3.072 1.00 52.14 O ATOM 0 H ASP A 138 -5.919 18.808 1.288 1.00 53.54 H new ATOM 0 HA ASP A 138 -7.829 16.897 2.159 1.00 33.32 H new ATOM 0 HB2 ASP A 138 -8.483 18.732 3.717 1.00 11.31 H new ATOM 0 HB3 ASP A 138 -6.761 18.406 3.717 1.00 11.31 H new ATOM 2160 N GLY A 139 -9.721 17.205 0.596 1.00 4.44 N ATOM 2161 CA GLY A 139 -10.967 17.340 -0.164 1.00 24.21 C ATOM 2162 C GLY A 139 -10.984 16.526 -1.442 1.00 23.24 C ATOM 2163 O GLY A 139 -12.057 16.249 -1.984 1.00 24.42 O ATOM 0 H GLY A 139 -9.424 16.239 0.736 1.00 4.44 H new ATOM 0 HA2 GLY A 139 -11.803 17.033 0.465 1.00 24.21 H new ATOM 0 HA3 GLY A 139 -11.122 18.391 -0.409 1.00 24.21 H new ATOM 2167 N ASP A 140 -9.790 16.164 -1.946 1.00 4.10 N ATOM 2168 CA ASP A 140 -9.645 15.303 -3.142 1.00 62.22 C ATOM 2169 C ASP A 140 -10.118 13.871 -2.852 1.00 33.23 C ATOM 2170 O ASP A 140 -10.345 13.503 -1.700 1.00 32.21 O ATOM 2171 CB ASP A 140 -8.176 15.295 -3.639 1.00 65.34 C ATOM 2172 CG ASP A 140 -7.736 16.653 -4.211 1.00 51.31 C ATOM 2173 OD1 ASP A 140 -7.308 17.522 -3.437 1.00 52.44 O ATOM 2174 OD2 ASP A 140 -7.828 16.856 -5.432 1.00 22.54 O ATOM 0 H ASP A 140 -8.901 16.456 -1.541 1.00 4.10 H new ATOM 0 HA ASP A 140 -10.275 15.718 -3.929 1.00 62.22 H new ATOM 0 HB2 ASP A 140 -7.519 15.023 -2.813 1.00 65.34 H new ATOM 0 HB3 ASP A 140 -8.060 14.528 -4.405 1.00 65.34 H new ATOM 2179 N GLU A 141 -10.309 13.080 -3.912 1.00 24.13 N ATOM 2180 CA GLU A 141 -10.748 11.675 -3.798 1.00 1.32 C ATOM 2181 C GLU A 141 -9.607 10.707 -4.161 1.00 42.02 C ATOM 2182 O GLU A 141 -8.660 11.080 -4.868 1.00 73.13 O ATOM 2183 CB GLU A 141 -11.978 11.474 -4.716 1.00 3.44 C ATOM 2184 CG GLU A 141 -13.187 12.360 -4.332 1.00 23.13 C ATOM 2185 CD GLU A 141 -14.297 12.365 -5.392 1.00 12.20 C ATOM 2186 OE1 GLU A 141 -14.232 13.196 -6.325 1.00 2.43 O ATOM 2187 OE2 GLU A 141 -15.226 11.534 -5.315 1.00 75.03 O ATOM 0 H GLU A 141 -10.166 13.389 -4.873 1.00 24.13 H new ATOM 0 HA GLU A 141 -11.025 11.455 -2.767 1.00 1.32 H new ATOM 0 HB2 GLU A 141 -11.692 11.690 -5.745 1.00 3.44 H new ATOM 0 HB3 GLU A 141 -12.280 10.427 -4.682 1.00 3.44 H new ATOM 0 HG2 GLU A 141 -13.599 12.010 -3.386 1.00 23.13 H new ATOM 0 HG3 GLU A 141 -12.843 13.382 -4.171 1.00 23.13 H new ATOM 2194 N ILE A 142 -9.724 9.456 -3.682 1.00 43.40 N ATOM 2195 CA ILE A 142 -8.713 8.401 -3.875 1.00 53.44 C ATOM 2196 C ILE A 142 -9.415 7.027 -3.844 1.00 30.24 C ATOM 2197 O ILE A 142 -10.453 6.868 -3.200 1.00 70.30 O ATOM 2198 CB ILE A 142 -7.588 8.469 -2.767 1.00 22.42 C ATOM 2199 CG1 ILE A 142 -6.450 7.414 -3.003 1.00 14.02 C ATOM 2200 CG2 ILE A 142 -8.195 8.321 -1.354 1.00 53.34 C ATOM 2201 CD1 ILE A 142 -5.677 7.566 -4.311 1.00 71.04 C ATOM 0 H ILE A 142 -10.533 9.145 -3.144 1.00 43.40 H new ATOM 0 HA ILE A 142 -8.227 8.550 -4.839 1.00 53.44 H new ATOM 0 HB ILE A 142 -7.127 9.454 -2.844 1.00 22.42 H new ATOM 0 HG12 ILE A 142 -5.744 7.474 -2.175 1.00 14.02 H new ATOM 0 HG13 ILE A 142 -6.890 6.417 -2.975 1.00 14.02 H new ATOM 0 HG21 ILE A 142 -7.400 8.371 -0.610 1.00 53.34 H new ATOM 0 HG22 ILE A 142 -8.908 9.126 -1.178 1.00 53.34 H new ATOM 0 HG23 ILE A 142 -8.705 7.361 -1.276 1.00 53.34 H new ATOM 0 HD11 ILE A 142 -4.915 6.789 -4.376 1.00 71.04 H new ATOM 0 HD12 ILE A 142 -6.364 7.472 -5.152 1.00 71.04 H new ATOM 0 HD13 ILE A 142 -5.200 8.546 -4.340 1.00 71.04 H new ATOM 2213 N THR A 143 -8.858 6.056 -4.565 1.00 51.53 N ATOM 2214 CA THR A 143 -9.364 4.677 -4.593 1.00 75.14 C ATOM 2215 C THR A 143 -8.446 3.774 -3.740 1.00 2.04 C ATOM 2216 O THR A 143 -7.222 3.824 -3.897 1.00 64.21 O ATOM 2217 CB THR A 143 -9.416 4.172 -6.069 1.00 74.22 C ATOM 2218 OG1 THR A 143 -10.093 5.142 -6.883 1.00 41.24 O ATOM 2219 CG2 THR A 143 -10.141 2.832 -6.193 1.00 72.12 C ATOM 0 H THR A 143 -8.037 6.201 -5.152 1.00 51.53 H new ATOM 0 HA THR A 143 -10.371 4.643 -4.177 1.00 75.14 H new ATOM 0 HB THR A 143 -8.388 4.034 -6.404 1.00 74.22 H new ATOM 0 HG1 THR A 143 -10.124 4.826 -7.810 1.00 41.24 H new ATOM 0 HG21 THR A 143 -10.153 2.520 -7.237 1.00 72.12 H new ATOM 0 HG22 THR A 143 -9.623 2.082 -5.596 1.00 72.12 H new ATOM 0 HG23 THR A 143 -11.165 2.938 -5.834 1.00 72.12 H new ATOM 2227 N LEU A 144 -9.034 2.956 -2.836 1.00 13.21 N ATOM 2228 CA LEU A 144 -8.283 2.048 -1.936 1.00 53.04 C ATOM 2229 C LEU A 144 -8.437 0.610 -2.442 1.00 64.12 C ATOM 2230 O LEU A 144 -9.475 -0.041 -2.218 1.00 43.15 O ATOM 2231 CB LEU A 144 -8.767 2.165 -0.449 1.00 73.31 C ATOM 2232 CG LEU A 144 -8.158 3.324 0.401 1.00 34.22 C ATOM 2233 CD1 LEU A 144 -6.628 3.166 0.545 1.00 52.41 C ATOM 2234 CD2 LEU A 144 -8.527 4.701 -0.177 1.00 74.51 C ATOM 0 H LEU A 144 -10.045 2.907 -2.710 1.00 13.21 H new ATOM 0 HA LEU A 144 -7.232 2.337 -1.949 1.00 53.04 H new ATOM 0 HB2 LEU A 144 -9.851 2.280 -0.453 1.00 73.31 H new ATOM 0 HB3 LEU A 144 -8.548 1.223 0.054 1.00 73.31 H new ATOM 0 HG LEU A 144 -8.593 3.263 1.399 1.00 34.22 H new ATOM 0 HD11 LEU A 144 -6.232 3.988 1.142 1.00 52.41 H new ATOM 0 HD12 LEU A 144 -6.405 2.219 1.037 1.00 52.41 H new ATOM 0 HD13 LEU A 144 -6.166 3.179 -0.442 1.00 52.41 H new ATOM 0 HD21 LEU A 144 -8.086 5.484 0.440 1.00 74.51 H new ATOM 0 HD22 LEU A 144 -8.145 4.783 -1.195 1.00 74.51 H new ATOM 0 HD23 LEU A 144 -9.611 4.813 -0.186 1.00 74.51 H new ATOM 2246 N ASP A 145 -7.416 0.149 -3.162 1.00 44.15 N ATOM 2247 CA ASP A 145 -7.346 -1.203 -3.708 1.00 12.41 C ATOM 2248 C ASP A 145 -6.649 -2.162 -2.735 1.00 42.54 C ATOM 2249 O ASP A 145 -5.421 -2.323 -2.775 1.00 0.11 O ATOM 2250 CB ASP A 145 -6.591 -1.176 -5.057 1.00 4.12 C ATOM 2251 CG ASP A 145 -7.424 -0.616 -6.210 1.00 63.13 C ATOM 2252 OD1 ASP A 145 -7.413 0.614 -6.448 1.00 71.15 O ATOM 2253 OD2 ASP A 145 -8.089 -1.418 -6.882 1.00 13.33 O ATOM 0 H ASP A 145 -6.599 0.717 -3.386 1.00 44.15 H new ATOM 0 HA ASP A 145 -8.363 -1.565 -3.862 1.00 12.41 H new ATOM 0 HB2 ASP A 145 -5.688 -0.576 -4.947 1.00 4.12 H new ATOM 0 HB3 ASP A 145 -6.273 -2.188 -5.307 1.00 4.12 H new ATOM 2258 N PHE A 146 -7.447 -2.815 -1.872 1.00 4.43 N ATOM 2259 CA PHE A 146 -6.960 -3.904 -0.988 1.00 10.12 C ATOM 2260 C PHE A 146 -6.673 -5.145 -1.845 1.00 51.33 C ATOM 2261 O PHE A 146 -5.896 -6.022 -1.482 1.00 50.11 O ATOM 2262 CB PHE A 146 -8.021 -4.245 0.091 1.00 33.40 C ATOM 2263 CG PHE A 146 -8.583 -3.019 0.792 1.00 43.42 C ATOM 2264 CD1 PHE A 146 -7.739 -2.146 1.467 1.00 62.20 C ATOM 2265 CD2 PHE A 146 -9.943 -2.718 0.738 1.00 20.50 C ATOM 2266 CE1 PHE A 146 -8.235 -1.016 2.071 1.00 24.42 C ATOM 2267 CE2 PHE A 146 -10.436 -1.581 1.340 1.00 43.20 C ATOM 2268 CZ PHE A 146 -9.581 -0.728 2.007 1.00 75.42 C ATOM 0 H PHE A 146 -8.440 -2.610 -1.763 1.00 4.43 H new ATOM 0 HA PHE A 146 -6.050 -3.579 -0.483 1.00 10.12 H new ATOM 0 HB2 PHE A 146 -8.839 -4.795 -0.375 1.00 33.40 H new ATOM 0 HB3 PHE A 146 -7.574 -4.906 0.833 1.00 33.40 H new ATOM 0 HD1 PHE A 146 -6.681 -2.358 1.518 1.00 62.20 H new ATOM 0 HD2 PHE A 146 -10.617 -3.383 0.219 1.00 20.50 H new ATOM 0 HE1 PHE A 146 -7.567 -0.351 2.598 1.00 24.42 H new ATOM 0 HE2 PHE A 146 -11.491 -1.358 1.290 1.00 43.20 H new ATOM 0 HZ PHE A 146 -9.966 0.164 2.478 1.00 75.42 H new ATOM 2278 N ASN A 147 -7.332 -5.159 -3.004 1.00 63.21 N ATOM 2279 CA ASN A 147 -7.216 -6.194 -4.026 1.00 73.13 C ATOM 2280 C ASN A 147 -5.943 -6.044 -4.884 1.00 53.41 C ATOM 2281 O ASN A 147 -5.774 -6.802 -5.834 1.00 25.53 O ATOM 2282 CB ASN A 147 -8.468 -6.136 -4.924 1.00 71.24 C ATOM 2283 CG ASN A 147 -8.701 -4.752 -5.546 1.00 71.45 C ATOM 2284 OD1 ASN A 147 -9.372 -3.907 -4.957 1.00 12.22 O ATOM 2285 ND2 ASN A 147 -8.148 -4.504 -6.726 1.00 13.54 N ATOM 0 H ASN A 147 -7.986 -4.421 -3.264 1.00 63.21 H new ATOM 0 HA ASN A 147 -7.140 -7.159 -3.525 1.00 73.13 H new ATOM 0 HB2 ASN A 147 -8.371 -6.874 -5.721 1.00 71.24 H new ATOM 0 HB3 ASN A 147 -9.342 -6.415 -4.336 1.00 71.24 H new ATOM 0 HD21 ASN A 147 -8.275 -3.593 -7.167 1.00 13.54 H new ATOM 0 HD22 ASN A 147 -7.596 -5.224 -7.192 1.00 13.54 H new ATOM 2292 N LEU A 148 -5.092 -5.036 -4.583 1.00 74.42 N ATOM 2293 CA LEU A 148 -3.764 -4.866 -5.227 1.00 53.22 C ATOM 2294 C LEU A 148 -2.657 -4.796 -4.141 1.00 15.14 C ATOM 2295 O LEU A 148 -1.545 -4.313 -4.406 1.00 3.54 O ATOM 2296 CB LEU A 148 -3.736 -3.576 -6.113 1.00 21.53 C ATOM 2297 CG LEU A 148 -4.814 -3.451 -7.248 1.00 43.21 C ATOM 2298 CD1 LEU A 148 -4.638 -2.142 -8.053 1.00 53.54 C ATOM 2299 CD2 LEU A 148 -4.828 -4.675 -8.182 1.00 71.34 C ATOM 0 H LEU A 148 -5.303 -4.319 -3.889 1.00 74.42 H new ATOM 0 HA LEU A 148 -3.579 -5.725 -5.872 1.00 53.22 H new ATOM 0 HB2 LEU A 148 -3.840 -2.714 -5.454 1.00 21.53 H new ATOM 0 HB3 LEU A 148 -2.751 -3.507 -6.576 1.00 21.53 H new ATOM 0 HG LEU A 148 -5.784 -3.416 -6.752 1.00 43.21 H new ATOM 0 HD11 LEU A 148 -5.400 -2.088 -8.830 1.00 53.54 H new ATOM 0 HD12 LEU A 148 -4.740 -1.287 -7.384 1.00 53.54 H new ATOM 0 HD13 LEU A 148 -3.650 -2.127 -8.512 1.00 53.54 H new ATOM 0 HD21 LEU A 148 -5.590 -4.539 -8.949 1.00 71.34 H new ATOM 0 HD22 LEU A 148 -3.852 -4.782 -8.656 1.00 71.34 H new ATOM 0 HD23 LEU A 148 -5.051 -5.571 -7.604 1.00 71.34 H new ATOM 2311 N ALA A 149 -2.970 -5.296 -2.924 1.00 2.24 N ATOM 2312 CA ALA A 149 -2.054 -5.238 -1.761 1.00 51.12 C ATOM 2313 C ALA A 149 -0.843 -6.187 -1.917 1.00 34.04 C ATOM 2314 O ALA A 149 -0.988 -7.331 -2.324 1.00 53.24 O ATOM 2315 CB ALA A 149 -2.812 -5.551 -0.460 1.00 12.32 C ATOM 0 H ALA A 149 -3.861 -5.749 -2.720 1.00 2.24 H new ATOM 0 HA ALA A 149 -1.664 -4.221 -1.714 1.00 51.12 H new ATOM 0 HB1 ALA A 149 -2.123 -5.504 0.383 1.00 12.32 H new ATOM 0 HB2 ALA A 149 -3.609 -4.821 -0.319 1.00 12.32 H new ATOM 0 HB3 ALA A 149 -3.242 -6.551 -0.521 1.00 12.32 H new ATOM 2321 N TYR A 150 0.346 -5.690 -1.563 1.00 44.22 N ATOM 2322 CA TYR A 150 1.613 -6.440 -1.643 1.00 24.24 C ATOM 2323 C TYR A 150 1.814 -7.281 -0.367 1.00 41.53 C ATOM 2324 O TYR A 150 1.432 -6.855 0.738 1.00 42.00 O ATOM 2325 CB TYR A 150 2.804 -5.456 -1.817 1.00 13.11 C ATOM 2326 CG TYR A 150 2.527 -4.309 -2.800 1.00 44.31 C ATOM 2327 CD1 TYR A 150 2.306 -4.552 -4.156 1.00 12.21 C ATOM 2328 CD2 TYR A 150 2.475 -2.984 -2.363 1.00 0.55 C ATOM 2329 CE1 TYR A 150 2.044 -3.519 -5.035 1.00 12.31 C ATOM 2330 CE2 TYR A 150 2.217 -1.953 -3.238 1.00 14.22 C ATOM 2331 CZ TYR A 150 2.001 -2.221 -4.573 1.00 44.44 C ATOM 2332 OH TYR A 150 1.739 -1.186 -5.452 1.00 31.40 O ATOM 0 H TYR A 150 0.462 -4.741 -1.207 1.00 44.22 H new ATOM 0 HA TYR A 150 1.571 -7.107 -2.504 1.00 24.24 H new ATOM 0 HB2 TYR A 150 3.059 -5.034 -0.845 1.00 13.11 H new ATOM 0 HB3 TYR A 150 3.675 -6.013 -2.161 1.00 13.11 H new ATOM 0 HD1 TYR A 150 2.340 -5.566 -4.525 1.00 12.21 H new ATOM 0 HD2 TYR A 150 2.640 -2.764 -1.319 1.00 0.55 H new ATOM 0 HE1 TYR A 150 1.873 -3.728 -6.081 1.00 12.31 H new ATOM 0 HE2 TYR A 150 2.184 -0.935 -2.879 1.00 14.22 H new ATOM 0 HH TYR A 150 0.927 -0.716 -5.171 1.00 31.40 H new ATOM 2342 N SER A 151 2.405 -8.474 -0.533 1.00 63.40 N ATOM 2343 CA SER A 151 2.803 -9.350 0.577 1.00 14.11 C ATOM 2344 C SER A 151 3.976 -8.726 1.401 1.00 31.55 C ATOM 2345 O SER A 151 4.792 -7.980 0.840 1.00 15.21 O ATOM 2346 CB SER A 151 3.174 -10.727 -0.017 1.00 73.52 C ATOM 2347 OG SER A 151 4.194 -10.616 -1.002 1.00 34.01 O ATOM 0 H SER A 151 2.622 -8.861 -1.452 1.00 63.40 H new ATOM 0 HA SER A 151 1.978 -9.469 1.280 1.00 14.11 H new ATOM 0 HB2 SER A 151 3.509 -11.390 0.781 1.00 73.52 H new ATOM 0 HB3 SER A 151 2.289 -11.183 -0.460 1.00 73.52 H new ATOM 0 HG SER A 151 4.977 -11.134 -0.722 1.00 34.01 H new ATOM 2353 N PRO A 152 4.074 -9.008 2.750 1.00 1.31 N ATOM 2354 CA PRO A 152 5.004 -8.277 3.637 1.00 73.21 C ATOM 2355 C PRO A 152 6.485 -8.700 3.497 1.00 62.34 C ATOM 2356 O PRO A 152 6.823 -9.869 3.726 1.00 54.14 O ATOM 2357 CB PRO A 152 4.449 -8.584 5.058 1.00 15.25 C ATOM 2358 CG PRO A 152 3.693 -9.881 4.945 1.00 73.40 C ATOM 2359 CD PRO A 152 3.296 -10.048 3.488 1.00 73.23 C ATOM 0 HA PRO A 152 5.035 -7.215 3.392 1.00 73.21 H new ATOM 0 HB2 PRO A 152 5.259 -8.668 5.782 1.00 15.25 H new ATOM 0 HB3 PRO A 152 3.796 -7.782 5.402 1.00 15.25 H new ATOM 0 HG2 PRO A 152 4.312 -10.716 5.273 1.00 73.40 H new ATOM 0 HG3 PRO A 152 2.810 -9.868 5.585 1.00 73.40 H new ATOM 0 HD2 PRO A 152 3.534 -11.048 3.127 1.00 73.23 H new ATOM 0 HD3 PRO A 152 2.224 -9.907 3.353 1.00 73.23 H new ATOM 2367 N PHE A 153 7.351 -7.725 3.111 1.00 42.24 N ATOM 2368 CA PHE A 153 8.831 -7.844 3.105 1.00 15.41 C ATOM 2369 C PHE A 153 9.385 -8.564 4.355 1.00 40.34 C ATOM 2370 O PHE A 153 10.055 -9.596 4.248 1.00 72.22 O ATOM 2371 CB PHE A 153 9.481 -6.429 3.080 1.00 21.05 C ATOM 2372 CG PHE A 153 9.026 -5.438 1.999 1.00 50.33 C ATOM 2373 CD1 PHE A 153 7.858 -4.677 2.156 1.00 35.15 C ATOM 2374 CD2 PHE A 153 9.800 -5.216 0.862 1.00 32.45 C ATOM 2375 CE1 PHE A 153 7.484 -3.743 1.206 1.00 72.25 C ATOM 2376 CE2 PHE A 153 9.422 -4.290 -0.087 1.00 1.22 C ATOM 2377 CZ PHE A 153 8.265 -3.551 0.083 1.00 11.32 C ATOM 0 H PHE A 153 7.029 -6.813 2.788 1.00 42.24 H new ATOM 0 HA PHE A 153 9.077 -8.426 2.217 1.00 15.41 H new ATOM 0 HB2 PHE A 153 9.306 -5.965 4.051 1.00 21.05 H new ATOM 0 HB3 PHE A 153 10.558 -6.560 2.979 1.00 21.05 H new ATOM 0 HD1 PHE A 153 7.242 -4.822 3.031 1.00 35.15 H new ATOM 0 HD2 PHE A 153 10.711 -5.779 0.722 1.00 32.45 H new ATOM 0 HE1 PHE A 153 6.582 -3.165 1.342 1.00 72.25 H new ATOM 0 HE2 PHE A 153 10.031 -4.141 -0.966 1.00 1.22 H new ATOM 0 HZ PHE A 153 7.973 -2.825 -0.661 1.00 11.32 H new ATOM 2387 N CYS A 154 9.067 -7.981 5.525 1.00 32.44 N ATOM 2388 CA CYS A 154 9.612 -8.387 6.831 1.00 62.14 C ATOM 2389 C CYS A 154 9.271 -9.844 7.201 1.00 24.21 C ATOM 2390 O CYS A 154 10.045 -10.500 7.904 1.00 33.31 O ATOM 2391 CB CYS A 154 9.101 -7.401 7.903 1.00 63.22 C ATOM 2392 SG CYS A 154 7.320 -7.091 7.828 1.00 43.34 S ATOM 0 H CYS A 154 8.413 -7.201 5.589 1.00 32.44 H new ATOM 0 HA CYS A 154 10.700 -8.351 6.775 1.00 62.14 H new ATOM 0 HB2 CYS A 154 9.350 -7.792 8.890 1.00 63.22 H new ATOM 0 HB3 CYS A 154 9.629 -6.454 7.792 1.00 63.22 H new ATOM 0 HG CYS A 154 7.109 -5.838 7.554 1.00 43.34 H new ATOM 2398 N ALA A 155 8.117 -10.339 6.720 1.00 1.30 N ATOM 2399 CA ALA A 155 7.659 -11.722 6.986 1.00 24.44 C ATOM 2400 C ALA A 155 8.410 -12.767 6.137 1.00 11.34 C ATOM 2401 O ALA A 155 8.527 -13.931 6.539 1.00 73.20 O ATOM 2402 CB ALA A 155 6.155 -11.821 6.753 1.00 63.04 C ATOM 0 H ALA A 155 7.476 -9.799 6.139 1.00 1.30 H new ATOM 0 HA ALA A 155 7.883 -11.948 8.029 1.00 24.44 H new ATOM 0 HB1 ALA A 155 5.823 -12.840 6.950 1.00 63.04 H new ATOM 0 HB2 ALA A 155 5.637 -11.135 7.423 1.00 63.04 H new ATOM 0 HB3 ALA A 155 5.929 -11.559 5.719 1.00 63.04 H new ATOM 2408 N TYR A 156 8.910 -12.355 4.962 1.00 73.22 N ATOM 2409 CA TYR A 156 9.685 -13.242 4.074 1.00 31.22 C ATOM 2410 C TYR A 156 11.175 -13.185 4.441 1.00 25.03 C ATOM 2411 O TYR A 156 11.862 -14.210 4.467 1.00 40.00 O ATOM 2412 CB TYR A 156 9.483 -12.845 2.592 1.00 30.12 C ATOM 2413 CG TYR A 156 8.107 -13.207 2.021 1.00 10.14 C ATOM 2414 CD1 TYR A 156 7.800 -14.525 1.681 1.00 74.11 C ATOM 2415 CD2 TYR A 156 7.128 -12.244 1.811 1.00 73.13 C ATOM 2416 CE1 TYR A 156 6.571 -14.866 1.154 1.00 22.42 C ATOM 2417 CE2 TYR A 156 5.899 -12.579 1.287 1.00 34.43 C ATOM 2418 CZ TYR A 156 5.622 -13.889 0.956 1.00 62.22 C ATOM 2419 OH TYR A 156 4.389 -14.227 0.435 1.00 0.21 O ATOM 0 H TYR A 156 8.792 -11.408 4.601 1.00 73.22 H new ATOM 0 HA TYR A 156 9.326 -14.263 4.207 1.00 31.22 H new ATOM 0 HB2 TYR A 156 9.632 -11.770 2.493 1.00 30.12 H new ATOM 0 HB3 TYR A 156 10.252 -13.330 1.991 1.00 30.12 H new ATOM 0 HD1 TYR A 156 8.541 -15.296 1.834 1.00 74.11 H new ATOM 0 HD2 TYR A 156 7.334 -11.214 2.063 1.00 73.13 H new ATOM 0 HE1 TYR A 156 6.355 -15.893 0.899 1.00 22.42 H new ATOM 0 HE2 TYR A 156 5.151 -11.815 1.135 1.00 34.43 H new ATOM 0 HH TYR A 156 3.813 -14.567 1.151 1.00 0.21 H new ATOM 2429 N SER A 157 11.656 -11.974 4.732 1.00 63.21 N ATOM 2430 CA SER A 157 13.057 -11.711 5.066 1.00 45.04 C ATOM 2431 C SER A 157 13.096 -10.740 6.251 1.00 43.12 C ATOM 2432 O SER A 157 12.696 -9.576 6.122 1.00 51.42 O ATOM 2433 CB SER A 157 13.798 -11.123 3.846 1.00 23.54 C ATOM 2434 OG SER A 157 13.696 -11.978 2.723 1.00 72.20 O ATOM 0 H SER A 157 11.074 -11.136 4.742 1.00 63.21 H new ATOM 0 HA SER A 157 13.559 -12.639 5.339 1.00 45.04 H new ATOM 0 HB2 SER A 157 13.382 -10.146 3.601 1.00 23.54 H new ATOM 0 HB3 SER A 157 14.848 -10.969 4.095 1.00 23.54 H new ATOM 0 HG SER A 157 13.089 -11.581 2.064 1.00 72.20 H new ATOM 2440 N ASP A 158 13.589 -11.228 7.398 1.00 35.45 N ATOM 2441 CA ASP A 158 13.607 -10.474 8.668 1.00 34.55 C ATOM 2442 C ASP A 158 14.662 -9.343 8.647 1.00 72.13 C ATOM 2443 O ASP A 158 14.653 -8.461 9.510 1.00 45.31 O ATOM 2444 CB ASP A 158 13.862 -11.453 9.839 1.00 1.22 C ATOM 2445 CG ASP A 158 13.755 -10.801 11.232 1.00 0.05 C ATOM 2446 OD1 ASP A 158 12.630 -10.682 11.759 1.00 72.31 O ATOM 2447 OD2 ASP A 158 14.790 -10.423 11.810 1.00 74.35 O ATOM 0 H ASP A 158 13.990 -12.163 7.475 1.00 35.45 H new ATOM 0 HA ASP A 158 12.637 -9.995 8.804 1.00 34.55 H new ATOM 0 HB2 ASP A 158 13.147 -12.273 9.776 1.00 1.22 H new ATOM 0 HB3 ASP A 158 14.855 -11.887 9.727 1.00 1.22 H new ATOM 2452 N THR A 159 15.542 -9.358 7.623 1.00 74.11 N ATOM 2453 CA THR A 159 16.539 -8.294 7.380 1.00 25.03 C ATOM 2454 C THR A 159 15.853 -6.942 7.105 1.00 12.32 C ATOM 2455 O THR A 159 16.476 -5.889 7.236 1.00 11.21 O ATOM 2456 CB THR A 159 17.496 -8.664 6.192 1.00 3.20 C ATOM 2457 OG1 THR A 159 18.523 -7.666 6.030 1.00 50.35 O ATOM 2458 CG2 THR A 159 16.739 -8.836 4.861 1.00 63.01 C ATOM 0 H THR A 159 15.581 -10.113 6.938 1.00 74.11 H new ATOM 0 HA THR A 159 17.138 -8.202 8.286 1.00 25.03 H new ATOM 0 HB THR A 159 17.951 -9.621 6.449 1.00 3.20 H new ATOM 0 HG1 THR A 159 19.109 -7.917 5.286 1.00 50.35 H new ATOM 0 HG21 THR A 159 17.445 -9.091 4.071 1.00 63.01 H new ATOM 0 HG22 THR A 159 16.003 -9.634 4.961 1.00 63.01 H new ATOM 0 HG23 THR A 159 16.232 -7.905 4.608 1.00 63.01 H new ATOM 2466 N PHE A 160 14.554 -6.991 6.744 1.00 14.53 N ATOM 2467 CA PHE A 160 13.727 -5.799 6.527 1.00 3.23 C ATOM 2468 C PHE A 160 13.205 -5.275 7.870 1.00 21.04 C ATOM 2469 O PHE A 160 13.397 -5.905 8.921 1.00 11.05 O ATOM 2470 CB PHE A 160 12.563 -6.123 5.552 1.00 73.40 C ATOM 2471 CG PHE A 160 13.003 -6.249 4.092 1.00 62.43 C ATOM 2472 CD1 PHE A 160 13.556 -7.428 3.610 1.00 21.31 C ATOM 2473 CD2 PHE A 160 12.883 -5.169 3.208 1.00 3.00 C ATOM 2474 CE1 PHE A 160 13.977 -7.531 2.299 1.00 70.45 C ATOM 2475 CE2 PHE A 160 13.308 -5.271 1.895 1.00 30.31 C ATOM 2476 CZ PHE A 160 13.855 -6.451 1.442 1.00 63.05 C ATOM 0 H PHE A 160 14.052 -7.866 6.596 1.00 14.53 H new ATOM 0 HA PHE A 160 14.333 -5.016 6.071 1.00 3.23 H new ATOM 0 HB2 PHE A 160 12.090 -7.055 5.862 1.00 73.40 H new ATOM 0 HB3 PHE A 160 11.808 -5.341 5.629 1.00 73.40 H new ATOM 0 HD1 PHE A 160 13.658 -8.277 4.270 1.00 21.31 H new ATOM 0 HD2 PHE A 160 12.452 -4.242 3.557 1.00 3.00 H new ATOM 0 HE1 PHE A 160 14.403 -8.457 1.941 1.00 70.45 H new ATOM 0 HE2 PHE A 160 13.211 -4.428 1.227 1.00 30.31 H new ATOM 0 HZ PHE A 160 14.189 -6.534 0.418 1.00 63.05 H new ATOM 2486 N SER A 161 12.548 -4.119 7.830 1.00 33.33 N ATOM 2487 CA SER A 161 12.116 -3.403 9.032 1.00 44.41 C ATOM 2488 C SER A 161 10.629 -3.656 9.298 1.00 63.40 C ATOM 2489 O SER A 161 9.845 -3.803 8.365 1.00 64.35 O ATOM 2490 CB SER A 161 12.409 -1.897 8.890 1.00 3.51 C ATOM 2491 OG SER A 161 12.022 -1.184 10.055 1.00 41.30 O ATOM 0 H SER A 161 12.298 -3.649 6.960 1.00 33.33 H new ATOM 0 HA SER A 161 12.678 -3.777 9.888 1.00 44.41 H new ATOM 0 HB2 SER A 161 13.473 -1.747 8.706 1.00 3.51 H new ATOM 0 HB3 SER A 161 11.877 -1.501 8.025 1.00 3.51 H new ATOM 0 HG SER A 161 12.675 -0.476 10.237 1.00 41.30 H new ATOM 2497 N CYS A 162 10.271 -3.754 10.587 1.00 21.33 N ATOM 2498 CA CYS A 162 8.877 -3.829 11.025 1.00 1.33 C ATOM 2499 C CYS A 162 8.372 -2.377 11.223 1.00 4.11 C ATOM 2500 O CYS A 162 8.778 -1.714 12.187 1.00 64.31 O ATOM 2501 CB CYS A 162 8.765 -4.659 12.324 1.00 42.33 C ATOM 2502 SG CYS A 162 9.752 -4.021 13.696 1.00 0.13 S ATOM 0 H CYS A 162 10.944 -3.783 11.353 1.00 21.33 H new ATOM 0 HA CYS A 162 8.260 -4.331 10.280 1.00 1.33 H new ATOM 0 HB2 CYS A 162 7.719 -4.696 12.629 1.00 42.33 H new ATOM 0 HB3 CYS A 162 9.073 -5.684 12.115 1.00 42.33 H new ATOM 0 HG CYS A 162 9.771 -2.722 13.650 1.00 0.13 H new ATOM 2508 N PRO A 163 7.541 -1.829 10.270 1.00 40.34 N ATOM 2509 CA PRO A 163 7.044 -0.424 10.316 1.00 33.50 C ATOM 2510 C PRO A 163 6.221 -0.114 11.570 1.00 20.13 C ATOM 2511 O PRO A 163 5.825 -1.022 12.300 1.00 21.32 O ATOM 2512 CB PRO A 163 6.173 -0.301 9.036 1.00 10.44 C ATOM 2513 CG PRO A 163 6.668 -1.386 8.142 1.00 11.11 C ATOM 2514 CD PRO A 163 7.007 -2.527 9.069 1.00 4.53 C ATOM 0 HA PRO A 163 7.868 0.288 10.355 1.00 33.50 H new ATOM 0 HB2 PRO A 163 5.114 -0.426 9.263 1.00 10.44 H new ATOM 0 HB3 PRO A 163 6.286 0.679 8.572 1.00 10.44 H new ATOM 0 HG2 PRO A 163 5.908 -1.678 7.417 1.00 11.11 H new ATOM 0 HG3 PRO A 163 7.542 -1.064 7.576 1.00 11.11 H new ATOM 0 HD2 PRO A 163 6.130 -3.129 9.307 1.00 4.53 H new ATOM 0 HD3 PRO A 163 7.745 -3.199 8.630 1.00 4.53 H new ATOM 2522 N LEU A 164 5.949 1.173 11.801 1.00 62.24 N ATOM 2523 CA LEU A 164 5.157 1.637 12.947 1.00 13.44 C ATOM 2524 C LEU A 164 3.833 2.206 12.400 1.00 1.22 C ATOM 2525 O LEU A 164 3.767 3.385 12.037 1.00 51.45 O ATOM 2526 CB LEU A 164 5.940 2.697 13.777 1.00 74.21 C ATOM 2527 CG LEU A 164 5.226 3.213 15.068 1.00 63.42 C ATOM 2528 CD1 LEU A 164 4.920 2.054 16.040 1.00 24.22 C ATOM 2529 CD2 LEU A 164 6.050 4.322 15.755 1.00 63.33 C ATOM 0 H LEU A 164 6.273 1.928 11.196 1.00 62.24 H new ATOM 0 HA LEU A 164 4.950 0.810 13.626 1.00 13.44 H new ATOM 0 HB2 LEU A 164 6.901 2.270 14.062 1.00 74.21 H new ATOM 0 HB3 LEU A 164 6.149 3.552 13.134 1.00 74.21 H new ATOM 0 HG LEU A 164 4.273 3.649 14.769 1.00 63.42 H new ATOM 0 HD11 LEU A 164 4.423 2.445 16.928 1.00 24.22 H new ATOM 0 HD12 LEU A 164 4.269 1.330 15.550 1.00 24.22 H new ATOM 0 HD13 LEU A 164 5.851 1.567 16.330 1.00 24.22 H new ATOM 0 HD21 LEU A 164 5.528 4.661 16.650 1.00 63.33 H new ATOM 0 HD22 LEU A 164 7.028 3.930 16.032 1.00 63.33 H new ATOM 0 HD23 LEU A 164 6.176 5.160 15.069 1.00 63.33 H new ATOM 2541 N PRO A 165 2.774 1.351 12.242 1.00 33.01 N ATOM 2542 CA PRO A 165 1.473 1.795 11.737 1.00 41.33 C ATOM 2543 C PRO A 165 0.584 2.362 12.878 1.00 52.11 C ATOM 2544 O PRO A 165 0.408 1.700 13.909 1.00 4.13 O ATOM 2545 CB PRO A 165 0.899 0.500 11.120 1.00 10.33 C ATOM 2546 CG PRO A 165 1.461 -0.623 11.943 1.00 65.14 C ATOM 2547 CD PRO A 165 2.761 -0.112 12.552 1.00 0.35 C ATOM 0 HA PRO A 165 1.531 2.614 11.020 1.00 41.33 H new ATOM 0 HB2 PRO A 165 -0.191 0.501 11.150 1.00 10.33 H new ATOM 0 HB3 PRO A 165 1.189 0.402 10.074 1.00 10.33 H new ATOM 0 HG2 PRO A 165 0.759 -0.920 12.722 1.00 65.14 H new ATOM 0 HG3 PRO A 165 1.643 -1.502 11.325 1.00 65.14 H new ATOM 0 HD2 PRO A 165 2.792 -0.290 13.627 1.00 0.35 H new ATOM 0 HD3 PRO A 165 3.626 -0.616 12.121 1.00 0.35 H new ATOM 2555 N PRO A 166 0.038 3.611 12.729 1.00 43.41 N ATOM 2556 CA PRO A 166 -0.874 4.217 13.735 1.00 30.33 C ATOM 2557 C PRO A 166 -2.129 3.339 13.946 1.00 33.41 C ATOM 2558 O PRO A 166 -2.679 2.836 12.980 1.00 45.30 O ATOM 2559 CB PRO A 166 -1.232 5.600 13.110 1.00 32.23 C ATOM 2560 CG PRO A 166 -0.934 5.454 11.649 1.00 10.43 C ATOM 2561 CD PRO A 166 0.263 4.537 11.580 1.00 3.35 C ATOM 0 HA PRO A 166 -0.424 4.310 14.724 1.00 30.33 H new ATOM 0 HB2 PRO A 166 -2.280 5.849 13.276 1.00 32.23 H new ATOM 0 HB3 PRO A 166 -0.640 6.400 13.556 1.00 32.23 H new ATOM 0 HG2 PRO A 166 -1.785 5.032 11.114 1.00 10.43 H new ATOM 0 HG3 PRO A 166 -0.717 6.420 11.193 1.00 10.43 H new ATOM 0 HD2 PRO A 166 0.308 4.001 10.632 1.00 3.35 H new ATOM 0 HD3 PRO A 166 1.199 5.086 11.680 1.00 3.35 H new ATOM 2569 N GLU A 167 -2.566 3.169 15.209 1.00 63.01 N ATOM 2570 CA GLU A 167 -3.672 2.242 15.585 1.00 71.34 C ATOM 2571 C GLU A 167 -5.006 2.528 14.838 1.00 31.25 C ATOM 2572 O GLU A 167 -5.888 1.668 14.785 1.00 72.25 O ATOM 2573 CB GLU A 167 -3.892 2.291 17.120 1.00 42.40 C ATOM 2574 CG GLU A 167 -2.629 1.963 17.938 1.00 72.34 C ATOM 2575 CD GLU A 167 -2.863 1.996 19.454 1.00 40.31 C ATOM 2576 OE1 GLU A 167 -2.925 3.104 20.022 1.00 42.32 O ATOM 2577 OE2 GLU A 167 -2.984 0.922 20.082 1.00 33.52 O ATOM 0 H GLU A 167 -2.167 3.667 16.004 1.00 63.01 H new ATOM 0 HA GLU A 167 -3.364 1.242 15.278 1.00 71.34 H new ATOM 0 HB2 GLU A 167 -4.245 3.285 17.396 1.00 42.40 H new ATOM 0 HB3 GLU A 167 -4.680 1.587 17.388 1.00 42.40 H new ATOM 0 HG2 GLU A 167 -2.267 0.975 17.655 1.00 72.34 H new ATOM 0 HG3 GLU A 167 -1.844 2.675 17.683 1.00 72.34 H new ATOM 2584 N SER A 168 -5.121 3.735 14.257 1.00 60.22 N ATOM 2585 CA SER A 168 -6.289 4.174 13.465 1.00 42.12 C ATOM 2586 C SER A 168 -6.347 3.499 12.067 1.00 2.42 C ATOM 2587 O SER A 168 -7.390 3.533 11.402 1.00 62.40 O ATOM 2588 CB SER A 168 -6.246 5.715 13.336 1.00 62.12 C ATOM 2589 OG SER A 168 -7.350 6.231 12.602 1.00 1.23 O ATOM 0 H SER A 168 -4.394 4.447 14.324 1.00 60.22 H new ATOM 0 HA SER A 168 -7.196 3.867 13.985 1.00 42.12 H new ATOM 0 HB2 SER A 168 -6.236 6.160 14.331 1.00 62.12 H new ATOM 0 HB3 SER A 168 -5.318 6.010 12.846 1.00 62.12 H new ATOM 0 HG SER A 168 -7.027 6.656 11.780 1.00 1.23 H new ATOM 2595 N ASN A 169 -5.241 2.852 11.643 1.00 41.10 N ATOM 2596 CA ASN A 169 -5.155 2.194 10.314 1.00 25.33 C ATOM 2597 C ASN A 169 -5.516 0.699 10.424 1.00 30.24 C ATOM 2598 O ASN A 169 -5.580 -0.016 9.411 1.00 22.43 O ATOM 2599 CB ASN A 169 -3.739 2.383 9.671 1.00 73.13 C ATOM 2600 CG ASN A 169 -2.667 1.357 10.110 1.00 71.44 C ATOM 2601 OD1 ASN A 169 -2.650 0.867 11.233 1.00 11.33 O ATOM 2602 ND2 ASN A 169 -1.769 1.020 9.213 1.00 24.14 N ATOM 0 H ASN A 169 -4.391 2.769 12.201 1.00 41.10 H new ATOM 0 HA ASN A 169 -5.879 2.675 9.656 1.00 25.33 H new ATOM 0 HB2 ASN A 169 -3.842 2.334 8.587 1.00 73.13 H new ATOM 0 HB3 ASN A 169 -3.380 3.384 9.912 1.00 73.13 H new ATOM 0 HD21 ASN A 169 -1.044 0.342 9.447 1.00 24.14 H new ATOM 0 HD22 ASN A 169 -1.796 1.437 8.282 1.00 24.14 H new ATOM 2609 N TRP A 170 -5.733 0.237 11.669 1.00 10.21 N ATOM 2610 CA TRP A 170 -6.075 -1.153 11.957 1.00 70.51 C ATOM 2611 C TRP A 170 -7.511 -1.427 11.507 1.00 13.10 C ATOM 2612 O TRP A 170 -8.461 -0.863 12.056 1.00 21.11 O ATOM 2613 CB TRP A 170 -5.916 -1.465 13.469 1.00 54.23 C ATOM 2614 CG TRP A 170 -4.490 -1.468 13.978 1.00 14.32 C ATOM 2615 CD1 TRP A 170 -3.336 -1.447 13.239 1.00 31.44 C ATOM 2616 CD2 TRP A 170 -4.075 -1.538 15.352 1.00 71.31 C ATOM 2617 NE1 TRP A 170 -2.245 -1.482 14.065 1.00 2.24 N ATOM 2618 CE2 TRP A 170 -2.670 -1.541 15.367 1.00 63.13 C ATOM 2619 CE3 TRP A 170 -4.760 -1.589 16.572 1.00 74.04 C ATOM 2620 CZ2 TRP A 170 -1.935 -1.603 16.550 1.00 20.55 C ATOM 2621 CZ3 TRP A 170 -4.030 -1.648 17.745 1.00 52.32 C ATOM 2622 CH2 TRP A 170 -2.630 -1.657 17.726 1.00 62.13 C ATOM 0 H TRP A 170 -5.674 0.825 12.500 1.00 10.21 H new ATOM 0 HA TRP A 170 -5.392 -1.802 11.409 1.00 70.51 H new ATOM 0 HB2 TRP A 170 -6.487 -0.731 14.038 1.00 54.23 H new ATOM 0 HB3 TRP A 170 -6.360 -2.440 13.672 1.00 54.23 H new ATOM 0 HD1 TRP A 170 -3.294 -1.408 12.161 1.00 31.44 H new ATOM 0 HE1 TRP A 170 -1.272 -1.467 13.760 1.00 2.24 H new ATOM 0 HE3 TRP A 170 -5.840 -1.582 16.597 1.00 74.04 H new ATOM 0 HZ2 TRP A 170 -0.855 -1.608 16.538 1.00 20.55 H new ATOM 0 HZ3 TRP A 170 -4.548 -1.688 18.692 1.00 52.32 H new ATOM 0 HH2 TRP A 170 -2.088 -1.708 18.659 1.00 62.13 H new ATOM 2633 N LEU A 171 -7.663 -2.280 10.493 1.00 73.44 N ATOM 2634 CA LEU A 171 -8.970 -2.680 9.986 1.00 63.10 C ATOM 2635 C LEU A 171 -9.443 -3.854 10.844 1.00 13.34 C ATOM 2636 O LEU A 171 -8.822 -4.926 10.808 1.00 3.24 O ATOM 2637 CB LEU A 171 -8.878 -3.073 8.480 1.00 2.12 C ATOM 2638 CG LEU A 171 -8.105 -2.083 7.541 1.00 71.51 C ATOM 2639 CD1 LEU A 171 -8.179 -2.535 6.068 1.00 13.52 C ATOM 2640 CD2 LEU A 171 -8.594 -0.628 7.701 1.00 52.44 C ATOM 0 H LEU A 171 -6.880 -2.712 10.002 1.00 73.44 H new ATOM 0 HA LEU A 171 -9.683 -1.858 10.049 1.00 63.10 H new ATOM 0 HB2 LEU A 171 -8.400 -4.050 8.412 1.00 2.12 H new ATOM 0 HB3 LEU A 171 -9.891 -3.186 8.095 1.00 2.12 H new ATOM 0 HG LEU A 171 -7.060 -2.106 7.849 1.00 71.51 H new ATOM 0 HD11 LEU A 171 -7.634 -1.828 5.443 1.00 13.52 H new ATOM 0 HD12 LEU A 171 -7.735 -3.525 5.969 1.00 13.52 H new ATOM 0 HD13 LEU A 171 -9.221 -2.571 5.750 1.00 13.52 H new ATOM 0 HD21 LEU A 171 -8.030 0.021 7.031 1.00 52.44 H new ATOM 0 HD22 LEU A 171 -9.654 -0.571 7.454 1.00 52.44 H new ATOM 0 HD23 LEU A 171 -8.444 -0.305 8.731 1.00 52.44 H new ATOM 2652 N GLU A 172 -10.498 -3.653 11.657 1.00 72.32 N ATOM 2653 CA GLU A 172 -11.006 -4.697 12.570 1.00 51.24 C ATOM 2654 C GLU A 172 -11.979 -5.615 11.790 1.00 12.30 C ATOM 2655 O GLU A 172 -13.162 -5.765 12.128 1.00 41.13 O ATOM 2656 CB GLU A 172 -11.654 -4.033 13.831 1.00 22.50 C ATOM 2657 CG GLU A 172 -11.577 -4.858 15.144 1.00 65.02 C ATOM 2658 CD GLU A 172 -12.319 -6.208 15.099 1.00 45.33 C ATOM 2659 OE1 GLU A 172 -13.559 -6.223 15.243 1.00 51.44 O ATOM 2660 OE2 GLU A 172 -11.672 -7.264 14.916 1.00 71.43 O ATOM 0 H GLU A 172 -11.016 -2.776 11.700 1.00 72.32 H new ATOM 0 HA GLU A 172 -10.193 -5.323 12.938 1.00 51.24 H new ATOM 0 HB2 GLU A 172 -11.171 -3.071 14.000 1.00 22.50 H new ATOM 0 HB3 GLU A 172 -12.702 -3.830 13.613 1.00 22.50 H new ATOM 0 HG2 GLU A 172 -10.529 -5.042 15.381 1.00 65.02 H new ATOM 0 HG3 GLU A 172 -11.987 -4.260 15.958 1.00 65.02 H new ATOM 2667 N THR A 173 -11.426 -6.216 10.732 1.00 54.23 N ATOM 2668 CA THR A 173 -12.120 -7.111 9.810 1.00 45.40 C ATOM 2669 C THR A 173 -11.060 -7.854 8.967 1.00 72.40 C ATOM 2670 O THR A 173 -9.910 -7.400 8.865 1.00 65.34 O ATOM 2671 CB THR A 173 -13.116 -6.330 8.880 1.00 42.53 C ATOM 2672 OG1 THR A 173 -13.866 -7.255 8.075 1.00 25.33 O ATOM 2673 CG2 THR A 173 -12.402 -5.306 7.967 1.00 44.30 C ATOM 0 H THR A 173 -10.444 -6.085 10.488 1.00 54.23 H new ATOM 0 HA THR A 173 -12.716 -7.822 10.382 1.00 45.40 H new ATOM 0 HB THR A 173 -13.787 -5.771 9.532 1.00 42.53 H new ATOM 0 HG1 THR A 173 -13.964 -6.895 7.169 1.00 25.33 H new ATOM 0 HG21 THR A 173 -13.139 -4.796 7.346 1.00 44.30 H new ATOM 0 HG22 THR A 173 -11.877 -4.575 8.581 1.00 44.30 H new ATOM 0 HG23 THR A 173 -11.687 -5.824 7.329 1.00 44.30 H new ATOM 2681 N ALA A 174 -11.441 -8.989 8.376 1.00 55.21 N ATOM 2682 CA ALA A 174 -10.531 -9.803 7.555 1.00 63.13 C ATOM 2683 C ALA A 174 -10.741 -9.446 6.078 1.00 71.54 C ATOM 2684 O ALA A 174 -11.883 -9.422 5.606 1.00 41.33 O ATOM 2685 CB ALA A 174 -10.777 -11.298 7.805 1.00 34.32 C ATOM 0 H ALA A 174 -12.384 -9.371 8.450 1.00 55.21 H new ATOM 0 HA ALA A 174 -9.497 -9.591 7.828 1.00 63.13 H new ATOM 0 HB1 ALA A 174 -10.096 -11.887 7.190 1.00 34.32 H new ATOM 0 HB2 ALA A 174 -10.604 -11.524 8.857 1.00 34.32 H new ATOM 0 HB3 ALA A 174 -11.806 -11.546 7.545 1.00 34.32 H new ATOM 2691 N VAL A 175 -9.644 -9.183 5.353 1.00 32.11 N ATOM 2692 CA VAL A 175 -9.701 -8.804 3.937 1.00 11.14 C ATOM 2693 C VAL A 175 -9.532 -10.085 3.107 1.00 64.21 C ATOM 2694 O VAL A 175 -8.410 -10.534 2.831 1.00 1.44 O ATOM 2695 CB VAL A 175 -8.615 -7.716 3.568 1.00 43.40 C ATOM 2696 CG1 VAL A 175 -8.650 -7.356 2.059 1.00 20.51 C ATOM 2697 CG2 VAL A 175 -8.790 -6.448 4.449 1.00 14.54 C ATOM 0 H VAL A 175 -8.698 -9.227 5.731 1.00 32.11 H new ATOM 0 HA VAL A 175 -10.662 -8.339 3.717 1.00 11.14 H new ATOM 0 HB VAL A 175 -7.634 -8.145 3.773 1.00 43.40 H new ATOM 0 HG11 VAL A 175 -7.889 -6.605 1.846 1.00 20.51 H new ATOM 0 HG12 VAL A 175 -8.454 -8.250 1.467 1.00 20.51 H new ATOM 0 HG13 VAL A 175 -9.632 -6.960 1.802 1.00 20.51 H new ATOM 0 HG21 VAL A 175 -8.033 -5.711 4.180 1.00 14.54 H new ATOM 0 HG22 VAL A 175 -9.782 -6.026 4.286 1.00 14.54 H new ATOM 0 HG23 VAL A 175 -8.678 -6.716 5.499 1.00 14.54 H new ATOM 2707 N THR A 176 -10.677 -10.718 2.797 1.00 24.12 N ATOM 2708 CA THR A 176 -10.739 -11.927 1.975 1.00 2.14 C ATOM 2709 C THR A 176 -10.688 -11.549 0.484 1.00 53.43 C ATOM 2710 O THR A 176 -11.720 -11.466 -0.201 1.00 73.21 O ATOM 2711 CB THR A 176 -12.031 -12.745 2.325 1.00 21.32 C ATOM 2712 OG1 THR A 176 -13.194 -11.896 2.229 1.00 3.52 O ATOM 2713 CG2 THR A 176 -11.964 -13.341 3.745 1.00 44.32 C ATOM 0 H THR A 176 -11.591 -10.397 3.116 1.00 24.12 H new ATOM 0 HA THR A 176 -9.878 -12.561 2.187 1.00 2.14 H new ATOM 0 HB THR A 176 -12.100 -13.564 1.609 1.00 21.32 H new ATOM 0 HG1 THR A 176 -13.996 -12.415 2.447 1.00 3.52 H new ATOM 0 HG21 THR A 176 -12.877 -13.900 3.949 1.00 44.32 H new ATOM 0 HG22 THR A 176 -11.106 -14.009 3.819 1.00 44.32 H new ATOM 0 HG23 THR A 176 -11.861 -12.536 4.473 1.00 44.32 H new ATOM 2721 N ALA A 177 -9.466 -11.284 0.004 1.00 71.01 N ATOM 2722 CA ALA A 177 -9.220 -10.794 -1.359 1.00 51.10 C ATOM 2723 C ALA A 177 -7.823 -11.192 -1.826 1.00 2.43 C ATOM 2724 O ALA A 177 -6.910 -11.364 -1.010 1.00 74.43 O ATOM 2725 CB ALA A 177 -9.394 -9.265 -1.438 1.00 20.51 C ATOM 0 H ALA A 177 -8.615 -11.404 0.553 1.00 71.01 H new ATOM 0 HA ALA A 177 -9.955 -11.254 -2.019 1.00 51.10 H new ATOM 0 HB1 ALA A 177 -9.206 -8.930 -2.458 1.00 20.51 H new ATOM 0 HB2 ALA A 177 -10.411 -8.999 -1.150 1.00 20.51 H new ATOM 0 HB3 ALA A 177 -8.688 -8.783 -0.762 1.00 20.51 H new ATOM 2731 N GLY A 178 -7.682 -11.287 -3.149 1.00 61.11 N ATOM 2732 CA GLY A 178 -6.437 -11.642 -3.802 1.00 71.22 C ATOM 2733 C GLY A 178 -5.816 -12.966 -3.382 1.00 63.00 C ATOM 2734 O GLY A 178 -6.514 -13.892 -2.961 1.00 73.40 O ATOM 0 H GLY A 178 -8.447 -11.115 -3.801 1.00 61.11 H new ATOM 0 HA2 GLY A 178 -6.609 -11.670 -4.878 1.00 71.22 H new ATOM 0 HA3 GLY A 178 -5.713 -10.849 -3.615 1.00 71.22 H new ATOM 2738 N GLU A 179 -4.481 -13.034 -3.502 1.00 50.23 N ATOM 2739 CA GLU A 179 -3.705 -14.249 -3.242 1.00 11.44 C ATOM 2740 C GLU A 179 -3.401 -14.381 -1.748 1.00 65.00 C ATOM 2741 O GLU A 179 -2.964 -13.413 -1.107 1.00 32.10 O ATOM 2742 CB GLU A 179 -2.401 -14.224 -4.088 1.00 75.24 C ATOM 2743 CG GLU A 179 -2.640 -14.080 -5.607 1.00 44.22 C ATOM 2744 CD GLU A 179 -3.509 -15.214 -6.196 1.00 41.23 C ATOM 2745 OE1 GLU A 179 -2.968 -16.297 -6.497 1.00 24.41 O ATOM 2746 OE2 GLU A 179 -4.735 -15.035 -6.341 1.00 2.03 O ATOM 0 H GLU A 179 -3.908 -12.239 -3.785 1.00 50.23 H new ATOM 0 HA GLU A 179 -4.289 -15.122 -3.535 1.00 11.44 H new ATOM 0 HB2 GLU A 179 -1.776 -13.398 -3.749 1.00 75.24 H new ATOM 0 HB3 GLU A 179 -1.843 -15.142 -3.904 1.00 75.24 H new ATOM 0 HG2 GLU A 179 -3.122 -13.122 -5.803 1.00 44.22 H new ATOM 0 HG3 GLU A 179 -1.678 -14.064 -6.120 1.00 44.22 H new ATOM 2753 N ARG A 180 -3.631 -15.583 -1.198 1.00 53.22 N ATOM 2754 CA ARG A 180 -3.421 -15.865 0.228 1.00 31.13 C ATOM 2755 C ARG A 180 -2.387 -16.988 0.389 1.00 73.24 C ATOM 2756 O ARG A 180 -2.488 -18.047 -0.248 1.00 23.12 O ATOM 2757 CB ARG A 180 -4.783 -16.271 0.876 1.00 4.03 C ATOM 2758 CG ARG A 180 -5.507 -17.445 0.163 1.00 72.42 C ATOM 2759 CD ARG A 180 -6.879 -17.785 0.768 1.00 41.04 C ATOM 2760 NE ARG A 180 -7.554 -18.867 0.018 1.00 42.40 N ATOM 2761 CZ ARG A 180 -8.883 -18.982 -0.168 1.00 0.24 C ATOM 2762 NH1 ARG A 180 -9.728 -18.083 0.331 1.00 3.15 N ATOM 2763 NH2 ARG A 180 -9.357 -20.004 -0.864 1.00 75.35 N ATOM 0 H ARG A 180 -3.968 -16.386 -1.730 1.00 53.22 H new ATOM 0 HA ARG A 180 -3.041 -14.975 0.730 1.00 31.13 H new ATOM 0 HB2 ARG A 180 -4.609 -16.545 1.916 1.00 4.03 H new ATOM 0 HB3 ARG A 180 -5.442 -15.403 0.881 1.00 4.03 H new ATOM 0 HG2 ARG A 180 -5.636 -17.194 -0.890 1.00 72.42 H new ATOM 0 HG3 ARG A 180 -4.872 -18.330 0.204 1.00 72.42 H new ATOM 0 HD2 ARG A 180 -6.754 -18.086 1.808 1.00 41.04 H new ATOM 0 HD3 ARG A 180 -7.508 -16.895 0.768 1.00 41.04 H new ATOM 0 HE ARG A 180 -6.962 -19.588 -0.394 1.00 42.40 H new ATOM 0 HH11 ARG A 180 -9.372 -17.290 0.865 1.00 3.15 H new ATOM 0 HH12 ARG A 180 -10.731 -18.187 0.180 1.00 3.15 H new ATOM 0 HH21 ARG A 180 -8.717 -20.696 -1.254 1.00 75.35 H new ATOM 0 HH22 ARG A 180 -10.362 -20.099 -1.010 1.00 75.35 H new ATOM 2777 N THR A 181 -1.355 -16.724 1.192 1.00 4.53 N ATOM 2778 CA THR A 181 -0.476 -17.758 1.743 1.00 75.43 C ATOM 2779 C THR A 181 -0.943 -18.217 3.138 1.00 12.23 C ATOM 2780 O THR A 181 -1.931 -17.696 3.682 1.00 22.12 O ATOM 2781 CB THR A 181 0.988 -17.204 1.809 1.00 11.23 C ATOM 2782 OG1 THR A 181 0.987 -15.896 2.405 1.00 64.33 O ATOM 2783 CG2 THR A 181 1.631 -17.125 0.414 1.00 63.24 C ATOM 0 H THR A 181 -1.103 -15.779 1.481 1.00 4.53 H new ATOM 0 HA THR A 181 -0.512 -18.630 1.089 1.00 75.43 H new ATOM 0 HB THR A 181 1.575 -17.894 2.416 1.00 11.23 H new ATOM 0 HG1 THR A 181 1.870 -15.709 2.786 1.00 64.33 H new ATOM 0 HG21 THR A 181 2.645 -16.736 0.502 1.00 63.24 H new ATOM 0 HG22 THR A 181 1.661 -18.120 -0.030 1.00 63.24 H new ATOM 0 HG23 THR A 181 1.043 -16.463 -0.221 1.00 63.24 H new ATOM 2791 N ASP A 182 -0.207 -19.220 3.673 1.00 32.45 N ATOM 2792 CA ASP A 182 -0.439 -19.833 5.010 1.00 32.25 C ATOM 2793 C ASP A 182 -1.855 -20.453 5.198 1.00 54.35 C ATOM 2794 O ASP A 182 -2.178 -20.961 6.283 1.00 44.12 O ATOM 2795 CB ASP A 182 -0.123 -18.780 6.116 1.00 65.50 C ATOM 2796 CG ASP A 182 -0.094 -19.347 7.539 1.00 33.22 C ATOM 2797 OD1 ASP A 182 0.705 -20.273 7.793 1.00 43.00 O ATOM 2798 OD2 ASP A 182 -0.845 -18.862 8.409 1.00 15.12 O ATOM 0 H ASP A 182 0.582 -19.637 3.179 1.00 32.45 H new ATOM 0 HA ASP A 182 0.240 -20.682 5.094 1.00 32.25 H new ATOM 0 HB2 ASP A 182 0.843 -18.323 5.900 1.00 65.50 H new ATOM 0 HB3 ASP A 182 -0.869 -17.987 6.069 1.00 65.50 H new ATOM 2803 N LEU A 183 -2.669 -20.465 4.127 1.00 13.34 N ATOM 2804 CA LEU A 183 -4.061 -20.956 4.158 1.00 53.52 C ATOM 2805 C LEU A 183 -4.106 -22.433 4.607 1.00 13.40 C ATOM 2806 O LEU A 183 -4.971 -22.837 5.391 1.00 50.13 O ATOM 2807 CB LEU A 183 -4.750 -20.764 2.772 1.00 70.11 C ATOM 2808 CG LEU A 183 -4.234 -21.629 1.565 1.00 43.54 C ATOM 2809 CD1 LEU A 183 -5.229 -21.586 0.390 1.00 60.13 C ATOM 2810 CD2 LEU A 183 -2.825 -21.202 1.090 1.00 51.34 C ATOM 0 H LEU A 183 -2.378 -20.132 3.208 1.00 13.34 H new ATOM 0 HA LEU A 183 -4.617 -20.366 4.887 1.00 53.52 H new ATOM 0 HB2 LEU A 183 -5.814 -20.966 2.897 1.00 70.11 H new ATOM 0 HB3 LEU A 183 -4.656 -19.714 2.495 1.00 70.11 H new ATOM 0 HG LEU A 183 -4.158 -22.654 1.928 1.00 43.54 H new ATOM 0 HD11 LEU A 183 -4.848 -22.192 -0.432 1.00 60.13 H new ATOM 0 HD12 LEU A 183 -6.193 -21.979 0.715 1.00 60.13 H new ATOM 0 HD13 LEU A 183 -5.352 -20.556 0.054 1.00 60.13 H new ATOM 0 HD21 LEU A 183 -2.516 -21.831 0.255 1.00 51.34 H new ATOM 0 HD22 LEU A 183 -2.849 -20.160 0.770 1.00 51.34 H new ATOM 0 HD23 LEU A 183 -2.115 -21.313 1.910 1.00 51.34 H new ATOM 2822 N GLU A 184 -3.120 -23.210 4.133 1.00 50.51 N ATOM 2823 CA GLU A 184 -2.918 -24.609 4.522 1.00 60.13 C ATOM 2824 C GLU A 184 -1.491 -24.755 5.067 1.00 64.40 C ATOM 2825 O GLU A 184 -0.554 -25.061 4.317 1.00 75.21 O ATOM 2826 CB GLU A 184 -3.166 -25.560 3.316 1.00 21.44 C ATOM 2827 CG GLU A 184 -4.574 -25.461 2.693 1.00 73.31 C ATOM 2828 CD GLU A 184 -4.765 -26.395 1.489 1.00 24.14 C ATOM 2829 OE1 GLU A 184 -4.451 -25.990 0.352 1.00 24.42 O ATOM 2830 OE2 GLU A 184 -5.206 -27.548 1.677 1.00 62.11 O ATOM 0 H GLU A 184 -2.432 -22.876 3.458 1.00 50.51 H new ATOM 0 HA GLU A 184 -3.633 -24.889 5.296 1.00 60.13 H new ATOM 0 HB2 GLU A 184 -2.427 -25.346 2.544 1.00 21.44 H new ATOM 0 HB3 GLU A 184 -2.999 -26.587 3.641 1.00 21.44 H new ATOM 0 HG2 GLU A 184 -5.319 -25.699 3.452 1.00 73.31 H new ATOM 0 HG3 GLU A 184 -4.755 -24.433 2.380 1.00 73.31 H new ATOM 2837 N HIS A 185 -1.316 -24.443 6.360 1.00 72.30 N ATOM 2838 CA HIS A 185 -0.020 -24.569 7.042 1.00 31.31 C ATOM 2839 C HIS A 185 0.285 -26.069 7.291 1.00 41.51 C ATOM 2840 O HIS A 185 -0.382 -26.682 8.151 1.00 13.34 O ATOM 2841 CB HIS A 185 -0.020 -23.754 8.367 1.00 23.30 C ATOM 2842 CG HIS A 185 1.320 -23.710 9.068 1.00 44.55 C ATOM 2843 ND1 HIS A 185 2.198 -22.659 8.930 1.00 12.41 N ATOM 2844 CD2 HIS A 185 1.923 -24.579 9.924 1.00 12.35 C ATOM 2845 CE1 HIS A 185 3.269 -22.876 9.663 1.00 51.34 C ATOM 2846 NE2 HIS A 185 3.131 -24.032 10.281 1.00 54.15 N ATOM 0 H HIS A 185 -2.065 -24.098 6.960 1.00 72.30 H new ATOM 0 HA HIS A 185 0.768 -24.158 6.411 1.00 31.31 H new ATOM 0 HB2 HIS A 185 -0.339 -22.734 8.153 1.00 23.30 H new ATOM 0 HB3 HIS A 185 -0.758 -24.183 9.045 1.00 23.30 H new ATOM 0 HD1 HIS A 185 2.042 -21.836 8.348 1.00 12.41 H new ATOM 0 HD2 HIS A 185 1.525 -25.525 10.261 1.00 12.35 H new ATOM 0 HE1 HIS A 185 4.120 -22.216 9.745 1.00 51.34 H new TER 2855 HIS A 185